| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 33 | Very low | 32.4 | Very low | 251 Ų | 251 | 156.3 Ų | 156.3 | 100% | 1.236 | 85% | 0.851 | S | S | * | * | 0 | 108.1 | 0 | -62.4 | 179.2 | 88 | 0 | 0 | 106.9 | |||||
| 2 | S | 35.5 | Very low | 32.8 | Very low | 111 Ų | 111 | 157.4 Ų | 157.4 | 78% | 0.776 | 85% | 0.854 | S | S | * | * | trans | -139.2 | 95.9 | 172.7 | 55.2 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 3 | E | 27.7 | Very low | 32.8 | Very low | 195 Ų | 195 | 156.4 Ų | 156.4 | 91% | 0.911 | 85% | 0.847 | S | S | * | * | trans | -63.5 | 127.1 | 170.1 | -81.2 | 173.7 | 125.3 | 0 | 0 | 109.3 | ||||
| 4 | V | 33.2 | Very low | 32.8 | Very low | 112 Ų | 112 | 154.2 Ų | 154.2 | 68% | 0.679 | 85% | 0.845 | S | S | * | * | trans | -99.6 | 104.4 | 169.5 | 178.1 | 0 | 0 | 0 | 0 | 106.8 | Y6 | V4-Y6 HydrophobicContact CG1-CE2 4.47Š| ||
| 5 | Q | 26.6 | Very low | 32.9 | Very low | 187 Ų | 187 | 155.4 Ų | 155.4 | 87% | 0.874 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -76 | 131.6 | 170.1 | -73 | 178.1 | -68.4 | 0 | 0 | 109.8 | ||
| 6 | Y | 37.4 | Very low | 32.8 | Very low | 199 Ų | 199 | 152.2 Ų | 152.2 | 78% | 0.78 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -94.2 | 144.1 | 169.2 | -70.6 | -85 | 0 | 0 | 0 | 110.3 | V4 | V4-Y6 HydrophobicContact CG1-CE2 4.47Š|
| 7 | P | 32.3 | Very low | 32.7 | Very low | 128 Ų | 128 | 151.2 Ų | 151.2 | 83% | 0.831 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 135.4 | -176.7 | -14.5 | 29 | 0 | 0 | 0 | 112.6 | ||
| 8 | L | 32.8 | Very low | 32.7 | Very low | 163 Ų | 163 | 151.8 Ų | 151.8 | 85% | 0.853 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -75.5 | 129.4 | 174.1 | -72.5 | 162 | 0 | 0 | 0 | 111.6 | ||
| 9 | E | 34.2 | Very low | 32.4 | Very low | 186 Ų | 186 | 152.5 Ų | 152.5 | 87% | 0.869 | 83% | 0.834 | S | S | * | * | trans | 34.6 | 116.8 | 148.3 | -53.3 | -162.4 | 160.6 | 0 | 0 | 120.8 | ||||
| 10 | G | 32 | Very low | 32.4 | Very low | 72 Ų | 72 | 152.9 Ų | 152.9 | 74% | 0.742 | 83% | 0.834 | S | S | * | * | trans | -102.1 | 130 | 153.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 11 | S | 31.8 | Very low | 32.2 | Very low | 115 Ų | 115 | 154.3 Ų | 154.3 | 80% | 0.804 | 84% | 0.835 | S | S | * | * | trans | -59.2 | 132.4 | -175.4 | 62.5 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 12 | L | 37.3 | Very low | 31.9 | Very low | 170 Ų | 170 | 154 Ų | 154 | 89% | 0.89 | 82% | 0.819 | S | S | * | * | trans | -107.8 | 124.2 | 165.6 | -70.3 | 173.9 | 0 | 0 | 0 | 109.4 | ||||
| 13 | D | 32.4 | Very low | 31.7 | Very low | 144 Ų | 144 | 154.1 Ų | 154.1 | 77% | 0.77 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 150.6 | 179.6 | -63.9 | -55.2 | 0 | 0 | 0 | 113.2 | M15 | D13-M15 PolarHBondContact O-N 3.07Š|
| 14 | P | 33.2 | Very low | 31.9 | Very low | 126 Ų | 126 | 152 Ų | 152 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 123.1 | -178.6 | 29.4 | -32.6 | 0 | 0 | 0 | 111.6 | ||
| 15 | M | 34.6 | Very low | 31.6 | Very low | 172 Ų | 172 | 154 Ų | 154 | 85% | 0.847 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 142.9 | 170 | -90.4 | -83.2 | 100.5 | 0 | 0 | 111.6 | D13 | D13-M15 PolarHBondContact O-N 3.07Š|
| 16 | P | 31.5 | Very low | 31.8 | Very low | 104 Ų | 104 | 151.1 Ų | 151.1 | 68% | 0.675 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -79.1 | 142.5 | -166.2 | 32.3 | -35.8 | 0 | 0 | 0 | 113.5 | M18 | P16-M18 PolarHBondContact O-N 3.39Š|
| 17 | T | 29.8 | Very low | 31.3 | Very low | 135 Ų | 135 | 147 Ų | 147 | 83% | 0.828 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 118.3 | 175.9 | -46.9 | 0 | 0 | 0 | 0 | 111.3 | ||
| 18 | M | 33 | Very low | 31.3 | Very low | 163 Ų | 163 | 148 Ų | 148 | 80% | 0.803 | 81% | 0.807 | S | S | * | * | trans | -112.7 | 124.3 | 165.6 | -72.8 | -117.9 | 72.5 | 0 | 0 | 109.7 | P16 | P16-M18 PolarHBondContact O-N 3.39Š| ||
| 19 | L | 27.5 | Very low | 30.9 | Very low | 164 Ų | 164 | 148.9 Ų | 148.9 | 86% | 0.859 | 81% | 0.806 | S | S | * | * | trans | -65.1 | 128.3 | 175.8 | -64.6 | 166 | 0 | 0 | 0 | 109.8 | ||||
| 20 | I | 32.2 | Very low | 30.8 | Very low | 161 Ų | 161 | 142.9 Ų | 142.9 | 83% | 0.826 | 80% | 0.795 | S | S | * | * | trans | -121.6 | 118.8 | 168.8 | -59.4 | 178.2 | 0 | 0 | 0 | 107.8 | ||||
| 21 | E | 29.2 | Very low | 30.6 | Very low | 183 Ų | 183 | 147.3 Ų | 147.3 | 86% | 0.855 | 80% | 0.801 | S | S | * | * | trans | -63 | 138.9 | 178.2 | -62.6 | 176.3 | 150.1 | 0 | 0 | 111.6 | ||||
| 22 | R | 25.2 | Very low | 30.7 | Very low | 243 Ų | 243 | 151 Ų | 151 | 92% | 0.917 | 81% | 0.806 | S | S | * | * | trans | -83 | 137.9 | 175.8 | -63.4 | 177.6 | 177.3 | -175.1 | -3.3 | 110.3 | ||||
| 23 | P | 31.6 | Very low | 30.5 | Very low | 114 Ų | 114 | 146.7 Ų | 146.7 | 74% | 0.74 | 80% | 0.795 | S | S | * | * | trans | -112 | 114.5 | 157.1 | 15.8 | 3.7 | 0 | 0 | 0 | 112 | ||||
| 24 | N | 31.7 | Very low | 30.4 | Very low | 151 Ų | 151 | 146.9 Ų | 146.9 | 81% | 0.807 | 80% | 0.796 | S | S | * | * | trans | 59.5 | 116.8 | 141.6 | -58.6 | -22.5 | 0 | 0 | 0 | 120.9 | ||||
| 25 | D | 26.7 | Very low | 30.1 | Very low | 154 Ų | 154 | 151.9 Ų | 151.9 | 82% | 0.824 | 80% | 0.798 | S | S | * | * | trans | -58.5 | 128.2 | 174.2 | -54.3 | -59.9 | 0 | 0 | 0 | 113.3 | ||||
| 26 | V | 31 | Very low | 29.8 | Very low | 126 Ų | 126 | 151.7 Ų | 151.7 | 76% | 0.764 | 80% | 0.796 | S | S | * | * | trans | -108.3 | 100 | 153.4 | 177.9 | 0 | 0 | 0 | 0 | 106.7 | I28 | V26-I28 HydrophobicContact CG1-CG1 4.16Å; V26-I28 PolarHBondContact O-N 3.04Å | ||
| 27 | V | 27.5 | Very low | 29.7 | Very low | 113 Ų | 113 | 154.7 Ų | 154.7 | 69% | 0.685 | 79% | 0.794 | S | S | * | * | trans | -67.4 | 111.2 | 171.5 | 176.9 | 0 | 0 | 0 | 0 | 108.2 | Q29 | V27-Q29 HydrophobicContact CG1-CG 3.96Š| ||
| 28 | I | 31.7 | Very low | 29.8 | Very low | 149 Ų | 149 | 153.1 Ų | 153.1 | 76% | 0.764 | 79% | 0.786 | S | S | * | * | trans | -108.8 | 97.5 | 159.8 | -56.8 | -170.6 | 0 | 0 | 0 | 106.7 | V26 | V26-I28 HydrophobicContact CG1-CG1 4.16Å; V26-I28 PolarHBondContact O-N 3.04Å | ||
| 29 | Q | 25.2 | Very low | 29.7 | Very low | 181 Ų | 181 | 148.4 Ų | 148.4 | 85% | 0.846 | 78% | 0.78 | S | S | * | * | trans | -70.7 | 121.9 | 162.8 | -77 | 174.1 | -25.9 | 0 | 0 | 108.1 | V27 | V27-Q29 HydrophobicContact CG1-CG 3.96Š| ||
| 30 | G | 31.1 | Very low | 29.8 | Very low | 61 Ų | 61 | 148.4 Ų | 148.4 | 63% | 0.629 | 77% | 0.773 | S | S | * | * | trans | 178.7 | 106.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | E32 | G30-E32 PolarHBondContact O-N 3.28Š| ||
| 31 | D | 29.4 | Very low | 29.5 | Very low | 164 Ų | 164 | 151.8 Ų | 151.8 | 88% | 0.877 | 78% | 0.775 | S | S | * | * | trans | -41.3 | 122 | -173.1 | -58.7 | -49.1 | 0 | 0 | 0 | 115.1 | A33 | D31-A33 PolarHBondContact O-N 3.21Š| ||
| 32 | E | 32.6 | Very low | 29.4 | Very low | 193 Ų | 193 | 151.7 Ų | 151.7 | 90% | 0.902 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.4 | 20.3 | -176.9 | -69.1 | -165.5 | 130.7 | 0 | 0 | 115.2 | G30 | G30-E32 PolarHBondContact O-N 3.28Š|
| 33 | A | 32.9 | Very low | 29.4 | Very low | 79 Ų | 79 | 146.1 Ų | 146.1 | 65% | 0.653 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.7 | -7.7 | -171 | 0 | 0 | 0 | 0 | 0 | 116.4 | D31 | D31-A33 PolarHBondContact O-N 3.21Š|
| 34 | N | 30 | Very low | 29.1 | Very low | 148 Ų | 148 | 148.4 Ų | 148.4 | 79% | 0.791 | 76% | 0.763 | S | S | * | * | trans | -148 | 54.3 | -172.7 | -78.2 | -55 | 0 | 0 | 0 | 115.2 | E36 | N34-E36 PolarHBondContact O-N 3.21Š| ||
| 35 | R | 27.4 | Very low | 28.9 | Very low | 231 Ų | 231 | 149 Ų | 149 | 87% | 0.872 | 77% | 0.766 | S | S | * | * | trans | -75.1 | 80.3 | 159.7 | -94.4 | -170.4 | -177.5 | 111 | 1.2 | 109.9 | Y37 | R35-Y37 PolarHBondContact O-N 3.42Š| ||
| 36 | E | 29.7 | Very low | 29.1 | Very low | 169 Ų | 169 | 146.5 Ų | 146.5 | 79% | 0.79 | 75% | 0.752 | S | S | * | * | trans | -71 | 108 | 168.2 | -161.3 | 166.9 | -156.7 | 0 | 0 | 108.6 | N34 P38 | N34-E36 PolarHBondContact O-N 3.21Å; E36-P38 WeakPolarHBondContact O-CD 3.22Å | ||
| 37 | Y | 29.2 | Very low | 29 | Very low | 166 Ų | 166 | 146.8 Ų | 146.8 | 65% | 0.651 | 75% | 0.749 | S | S | * | * | trans | -61.5 | 121.7 | 174.9 | -80.4 | -94.1 | 0 | 0 | 0 | 109.7 | R35 G39 | R35-Y37 PolarHBondContact O-N 3.42Å; Y37-G39 VanDerWaalsContact C-N 3.3Å; Y37-G39 PolarHBondContact O-N 3.38Å | ||
| 38 | P | 30.6 | Very low | 29.1 | Very low | 102 Ų | 102 | 152.1 Ų | 152.1 | 66% | 0.662 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.6 | 90.1 | 173.4 | 29 | -30.3 | 0 | 0 | 0 | 108.3 | E36 M168 | E36-P38 WeakPolarHBondContact O-CD 3.22Å; P38-M168 HydrophobicContact CG-SD 4.29Å |
| 39 | G | 31.4 | Very low | 29.2 | Very low | 64 Ų | 64 | 153.4 Ų | 153.4 | 66% | 0.66 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 177 | -8.3 | -176.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | Y37 R41 | Y37-G39 VanDerWaalsContact C-N 3.3Å; Y37-G39 PolarHBondContact O-N 3.38Å; G39-R41 PolarHBondContact O-N 3.38Å |
| 40 | K | 29.3 | Very low | 29.3 | Very low | 164 Ų | 164 | 152 Ų | 152 | 71% | 0.713 | 76% | 0.762 | S | S | * | * | trans | -74.4 | 71.3 | 173.3 | -68 | -173.1 | -178.7 | 179.3 | 0 | 111.6 | F42 | K40-F42 HydrophobicContact CB-CD2 4.48Å; K40-F42 HydrophobicContact CB-CE2 4.35Å; K40-F42 HydrophobicContact CD-CE2 4.37Å; K40-F42 HydrophobicContact CG-CE2 4.07Å | ||
| 41 | R | 26.9 | Very low | 29.3 | Very low | 233 Ų | 233 | 153.8 Ų | 153.8 | 88% | 0.879 | 77% | 0.771 | S | S | * | * | trans | -110.9 | 82.2 | 150.8 | -126.6 | 179.1 | -177.6 | 163.3 | 0.4 | 106.1 | G39 V43 | G39-R41 PolarHBondContact O-N 3.38Å; R41-V43 PolarHBondContact O-N 3.37Å; R41-V43 VanDerWaalsContact O-N 3.14Å | ||
| 42 | F | 26.2 | Very low | 29.2 | Very low | 181 Ų | 181 | 149.8 Ų | 149.8 | 79% | 0.794 | 77% | 0.768 | S | S | * | * | trans | -60.9 | 114.9 | 164.2 | -72.2 | -87.4 | 0 | 0 | 0 | 106.5 | K40 K44 | K40-F42 HydrophobicContact CB-CD2 4.48Å; K40-F42 HydrophobicContact CB-CE2 4.35Å; K40-F42 HydrophobicContact CD-CE2 4.37Å; K40-F42 HydrophobicContact CG-CE2 4.07Å; F42-K44 PolarHBondContact O-N 3.21Å; F42-K44 VanDerWaalsContact O-N 3.09Å | ||
| 43 | V | 25.8 | Very low | 29 | Very low | 125 Ų | 125 | 147.3 Ų | 147.3 | 76% | 0.758 | 77% | 0.766 | S | S | * | * | trans | -68.8 | 105.6 | 163.7 | 178.3 | 0 | 0 | 0 | 0 | 105.1 | R41 L45 | R41-V43 PolarHBondContact O-N 3.37Å; R41-V43 VanDerWaalsContact O-N 3.14Å; V43-L45 PolarHBondContact O-N 2.83Å | ||
| 44 | K | 25.4 | Very low | 28.8 | Very low | 162 Ų | 162 | 152.1 Ų | 152.1 | 70% | 0.704 | 78% | 0.775 | S | S | * | * | trans | -65.5 | 103.2 | 169 | -155.9 | -178.2 | -179.2 | -166.7 | 0 | 106.3 | F42 D46 | F42-K44 PolarHBondContact O-N 3.21Å; F42-K44 VanDerWaalsContact O-N 3.09Å; K44-D46 WeakPolarHBondContact CD-OD1 3.41Å; K44-D46 WeakPolarHBondContact CE-OD1 3.3Å; K44-D46 IonicContact NZ-OD1 2.75Å; K44-D46 PolarHBondContact O-N 2.81Å; K44-D46 VanDerWaalsContact O-N 3.07Å | ||
| 45 | L | 27.4 | Very low | 28.6 | Very low | 165 Ų | 165 | 153.3 Ų | 153.3 | 86% | 0.864 | 78% | 0.781 | S | S | * | * | trans | -75.6 | 87.5 | 165.9 | -75.5 | 169.1 | 0 | 0 | 0 | 106.3 | V43 | V43-L45 PolarHBondContact O-N 2.83Š| ||
| 46 | D | 29.6 | Very low | 28.7 | Very low | 101 Ų | 101 | 146.9 Ų | 146.9 | 54% | 0.54 | 78% | 0.777 | S | S | . | * | trans | -73.3 | 131.5 | 168.6 | -71.1 | -43.1 | 0 | 0 | 0 | 108.7 | K44 | K44-D46 WeakPolarHBondContact CD-OD1 3.41Å; K44-D46 WeakPolarHBondContact CE-OD1 3.3Å; K44-D46 IonicContact NZ-OD1 2.75Å; K44-D46 PolarHBondContact O-N 2.81Å; K44-D46 VanDerWaalsContact O-N 3.07Å | ||
| 47 | N | 29.5 | Very low | 28.6 | Very low | 132 Ų | 132 | 145.6 Ų | 145.6 | 71% | 0.706 | 78% | 0.776 | S | S | * | * | trans | 75.1 | 90.3 | 163.1 | -55 | -32.2 | 0 | 0 | 0 | 118.9 | ||||
| 48 | F | 30.4 | Very low | 28.7 | Very low | 224 Ų | 224 | 145.4 Ų | 145.4 | 98% | 0.982 | 79% | 0.786 | S | S | * | * | trans | -127.8 | 102.1 | 135.2 | -92.1 | -88.5 | 0 | 0 | 0 | 108.3 | ||||
| 49 | K | 34.1 | Very low | 28.5 | Very low | 176 Ų | 176 | 146.5 Ų | 146.5 | 77% | 0.765 | 80% | 0.795 | S | S | * | * | trans | -82.7 | 131.7 | 167.1 | -76.7 | -177.5 | 175.2 | -177.8 | 0 | 108.7 | ||||
| 50 | D | 27.4 | Very low | 28.4 | Very low | 151 Ų | 151 | 151.5 Ų | 151.5 | 81% | 0.807 | 80% | 0.801 | S | S | * | * | trans | 50 | 100.8 | 144.8 | -48.8 | -33.7 | 0 | 0 | 0 | 118.8 | ||||
| 51 | A | 31.3 | Very low | 28.5 | Very low | 99 Ų | 99 | 151.5 Ų | 151.5 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | trans | -161.4 | 105.3 | 134.1 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 52 | G | 25.7 | Very low | 28.6 | Very low | 80 Ų | 80 | 150.4 Ų | 150.4 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | trans | -70.6 | 139.7 | 170.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 53 | V | 28.5 | Very low | 28.9 | Very low | 142 Ų | 142 | 146.5 Ų | 146.5 | 86% | 0.861 | 80% | 0.8 | S | S | * | * | trans | -141.7 | 131 | 160 | 178.9 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 54 | E | 28.9 | Very low | 29 | Very low | 180 Ų | 180 | 145.9 Ų | 145.9 | 84% | 0.841 | 80% | 0.801 | S | S | * | * | trans | -64.6 | 153.9 | -176.7 | -60.5 | -178.7 | 136.7 | 0 | 0 | 113.4 | A56 | E54-A56 PolarHBondContact O-N 2.88Š| ||
| 55 | L | 26 | Very low | 29.3 | Very low | 173 Ų | 173 | 144.8 Ų | 144.8 | 91% | 0.906 | 81% | 0.808 | S | S | * | * | trans | -58.1 | 125.7 | 165.9 | -100 | 79.8 | 0 | 0 | 0 | 110.1 | ||||
| 56 | A | 29.6 | Very low | 29.3 | Very low | 96 Ų | 96 | 143.2 Ų | 143.2 | 79% | 0.793 | 81% | 0.806 | S | S | * | * | trans | -145.6 | 119.8 | 151.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | E54 | E54-A56 PolarHBondContact O-N 2.88Š| ||
| 57 | D | 27.1 | Very low | 29.5 | Very low | 142 Ų | 142 | 145.4 Ų | 145.4 | 76% | 0.759 | 82% | 0.816 | S | S | * | * | trans | -54.9 | 134.5 | 166.5 | -62.1 | -53.9 | 0 | 0 | 0 | 110.1 | ||||
| 58 | N | 31.8 | Very low | 29.4 | Very low | 162 Ų | 162 | 145.7 Ų | 145.7 | 87% | 0.866 | 82% | 0.823 | S | S | * | * | trans | 170.9 | 119.7 | 130.5 | -81.2 | -31.8 | 0 | 0 | 0 | 110.8 | ||||
| 59 | C | 27 | Very low | 29.6 | Very low | 125 Ų | 125 | 140.7 Ų | 140.7 | 85% | 0.845 | 81% | 0.811 | S | S | * | * | trans | -77.4 | 126.8 | 167 | -173.7 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 60 | E | 28 | Very low | 29.5 | Very low | 168 Ų | 168 | 138.1 Ų | 138.1 | 79% | 0.785 | 81% | 0.809 | S | S | * | * | trans | -179.5 | 131.9 | 135.8 | -100 | 175.5 | -155.4 | 0 | 0 | 110.9 | ||||
| 61 | H | 31.6 | Very low | 29.7 | Very low | 164 Ų | 164 | 136.9 Ų | 136.9 | 76% | 0.759 | 81% | 0.809 | S | S | * | * | trans | 52.3 | 113.5 | 153.6 | -71.2 | 63.7 | 0 | 0 | 0 | 118 | ||||
| 62 | F | 30.3 | Very low | 29.6 | Very low | 210 Ų | 210 | 139.6 Ų | 139.6 | 92% | 0.921 | 81% | 0.809 | S | S | * | * | -168 | 138.6 | 121.4 | -115.5 | -84.8 | 0 | 0 | 0 | 112.2 | |||||
| 63 | S | 31.3 | Very low | 30 | Very low | 99 Ų | 99 | 144.7 Ų | 144.7 | 69% | 0.692 | 81% | 0.811 | S | S | * | * | trans | -73.1 | 147.4 | -172.3 | -52.9 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 64 | S | 27.5 | Very low | 30.1 | Very low | 112 Ų | 112 | 145.9 Ų | 145.9 | 78% | 0.783 | 81% | 0.807 | S | S | * | * | trans | 49.2 | 107.6 | 137.7 | -49 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 65 | T | 31.5 | Very low | 30.3 | Very low | 139 Ų | 139 | 142.8 Ų | 142.8 | 85% | 0.853 | 80% | 0.803 | S | S | * | * | trans | -140.8 | 126.9 | 146.9 | -42.8 | 0 | 0 | 0 | 0 | 111 | ||||
| 66 | T | 27.7 | Very low | 30.8 | Very low | 132 Ų | 132 | 141.7 Ų | 141.7 | 81% | 0.81 | 80% | 0.796 | S | S | * | * | trans | -67.4 | 127.8 | -172.9 | -37.1 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 67 | I | 34.4 | Very low | 30.8 | Very low | 147 Ų | 147 | 146.1 Ų | 146.1 | 75% | 0.754 | 80% | 0.8 | S | S | * | * | trans | -123 | 116.3 | 164 | -61.1 | 179.1 | 0 | 0 | 0 | 109 | T69 | I67-T69 PolarHBondContact O-N 2.66Š| ||
| 68 | T | 27.7 | Very low | 31.1 | Very low | 138 Ų | 138 | 144.3 Ų | 144.3 | 85% | 0.847 | 80% | 0.798 | S | S | * | * | trans | -69.1 | 112.3 | 174.4 | -41.2 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 69 | T | 33.8 | Very low | 31.3 | Very low | 119 Ų | 119 | 140.8 Ų | 140.8 | 73% | 0.73 | 79% | 0.791 | S | S | * | * | trans | -147 | 123 | 170 | -10.9 | 0 | 0 | 0 | 0 | 112.8 | I67 | I67-T69 PolarHBondContact O-N 2.66Š| ||
| 70 | V | 32.9 | Very low | 31.8 | Very low | 122 Ų | 122 | 140.9 Ų | 140.9 | 74% | 0.739 | 79% | 0.79 | S | S | * | * | trans | -12.3 | 137 | 166.9 | -168.7 | 0 | 0 | 0 | 0 | 117.2 | I72 | V70-I72 PolarHBondContact O-N 3.49Å; V70-I72 VanDerWaalsContact O-N 3.11Å | ||
| 71 | P | 30.6 | Very low | 32.1 | Very low | 125 Ų | 125 | 138.1 Ų | 138.1 | 81% | 0.812 | 79% | 0.789 | S | S | * | * | trans | -68.7 | 112.1 | -175.3 | 28.1 | -33.1 | 0 | 0 | 0 | 111.3 | Q73 | P71-Q73 PolarHBondContact O-N 3.49Š| ||
| 72 | I | 29.8 | Very low | 32.3 | Very low | 156 Ų | 156 | 136.2 Ų | 136.2 | 80% | 0.8 | 78% | 0.784 | S | S | * | * | trans | -79.1 | 114.2 | 162.9 | -62 | 171.4 | 0 | 0 | 0 | 106.1 | V70 E74 | V70-I72 PolarHBondContact O-N 3.49Å; V70-I72 VanDerWaalsContact O-N 3.11Å; I72-E74 PolarHBondContact O-N 3.4Å; I72-E74 VanDerWaalsContact O-N 3.08Å | ||
| 73 | Q | 33.3 | Very low | 32.3 | Very low | 188 Ų | 188 | 135.8 Ų | 135.8 | 88% | 0.879 | 78% | 0.782 | S | S | * | * | trans | -67.6 | 106.3 | 176.3 | -139.3 | 159.1 | -7 | 0 | 0 | 108.3 | P71 | P71-Q73 PolarHBondContact O-N 3.49Š| ||
| 74 | E | 31.8 | Very low | 32.4 | Very low | 166 Ų | 166 | 136.5 Ų | 136.5 | 78% | 0.776 | 78% | 0.783 | S | S | * | * | trans | -61.6 | 135.8 | 177.5 | -63.3 | -172.3 | 155.3 | 0 | 0 | 110.2 | I72 I76 | I72-E74 PolarHBondContact O-N 3.4Å; I72-E74 VanDerWaalsContact O-N 3.08Å; E74-I76 PolarHBondContact O-N 2.83Å; E74-I76 VanDerWaalsContact O-N 3.08Å | ||
| 75 | P | 32.9 | Very low | 32.6 | Very low | 115 Ų | 115 | 137.4 Ų | 137.4 | 75% | 0.747 | 78% | 0.779 | S | S | * | * | trans | -69.9 | 112.1 | 174.4 | 25.1 | -25.5 | 0 | 0 | 0 | 108.8 | H77 | P75-H77 PolarHBondContact O-N 3.47Š| ||
| 76 | I | 35.4 | Very low | 32.6 | Very low | 151 Ų | 151 | 136.6 Ų | 136.6 | 77% | 0.774 | 78% | 0.776 | S | S | * | * | trans | -50.3 | 111.5 | 173.9 | -57.8 | 169.7 | 0 | 0 | 0 | 108.7 | E74 C78 | E74-I76 PolarHBondContact O-N 2.83Å; E74-I76 VanDerWaalsContact O-N 3.08Å; I76-C78 PolarHBondContact O-N 3.31Å | ||
| 77 | H | 31.3 | Very low | 32.7 | Very low | 189 Ų | 189 | 137.6 Ų | 137.6 | 88% | 0.875 | 77% | 0.774 | S | S | * | * | trans | -59.7 | 99.9 | 173 | -91.5 | -88.4 | 0 | 0 | 0 | 109.7 | P75 A79 | P75-H77 PolarHBondContact O-N 3.47Å; H77-A79 PolarHBondContact O-N 3.02Å | ||
| 78 | C | 32.6 | Very low | 32.6 | Very low | 104 Ų | 104 | 135.9 Ų | 135.9 | 70% | 0.703 | 77% | 0.773 | S | S | * | * | trans | -85.5 | 110.6 | 167.2 | -79.7 | 0 | 0 | 0 | 0 | 109.7 | I76 | I76-C78 PolarHBondContact O-N 3.31Š| ||
| 79 | A | 35.9 | Very low | 32.9 | Very low | 88 Ų | 88 | 135.4 Ų | 135.4 | 73% | 0.727 | 77% | 0.77 | S | S | * | * | trans | -52.3 | 150.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | H77 S81 | H77-A79 PolarHBondContact O-N 3.02Å; A79-S81 PolarHBondContact O-N 2.88Å | ||
| 80 | P | 38 | Very low | 33 | Very low | 126 Ų | 126 | 138.6 Ų | 138.6 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | trans | -74.3 | 112.2 | 168.3 | 1.1 | 16 | 0 | 0 | 0 | 109.2 | D82 | P80-D82 PolarHBondContact O-N 3.09Š| ||
| 81 | S | 33.3 | Very low | 33.1 | Very low | 110 Ų | 110 | 141.4 Ų | 141.4 | 77% | 0.769 | 78% | 0.781 | S | S | * | * | trans | -72.9 | 96.6 | 163.5 | 59.9 | 0 | 0 | 0 | 0 | 109.5 | A79 | A79-S81 PolarHBondContact O-N 2.88Š| ||
| 82 | D | 35.6 | Very low | 33.3 | Very low | 124 Ų | 124 | 142.7 Ų | 142.7 | 66% | 0.663 | 78% | 0.781 | S | S | * | * | trans | -118.6 | 102.1 | 157.4 | -95.4 | -19.2 | 0 | 0 | 0 | 108.1 | P80 T84 | P80-D82 PolarHBondContact O-N 3.09Å; D82-T84 VanDerWaalsContact C-N 3.32Å; D82-T84 PolarHBondContact O-N 3.14Å | ||
| 83 | K | 32 | Very low | 33.9 | Very low | 201 Ų | 201 | 143 Ų | 143 | 87% | 0.874 | 79% | 0.785 | S | S | * | * | trans | -74.2 | 81.3 | 174.1 | -67.6 | -176.6 | 177.1 | -174.7 | 0 | 109.3 | ||||
| 84 | T | 33 | Very low | 34.2 | Very low | 115 Ų | 115 | 137.6 Ų | 137.6 | 71% | 0.706 | 77% | 0.772 | S | S | * | * | trans | -176.5 | 96.4 | 156.4 | 42.6 | 0 | 0 | 0 | 0 | 108.4 | D82 | D82-T84 VanDerWaalsContact C-N 3.32Å; D82-T84 PolarHBondContact O-N 3.14Å | ||
| 85 | N | 31.8 | Very low | 34.5 | Very low | 130 Ų | 130 | 132.9 Ų | 132.9 | 70% | 0.695 | 76% | 0.762 | S | S | * | * | trans | 158.4 | 138.2 | 140.1 | -76.7 | -23.5 | 0 | 0 | 0 | 110.7 | ||||
| 86 | P | 30.2 | Very low | 35.3 | Very low | 122 Ų | 122 | 133.6 Ų | 133.6 | 79% | 0.792 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 131.3 | 178.6 | 20.8 | -15.6 | 0 | 0 | 0 | 110.2 | ||
| 87 | I | 30.2 | Very low | 36.1 | Very low | 153 Ų | 153 | 129.5 Ų | 129.5 | 79% | 0.785 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 124.2 | 167.7 | -62.3 | 168 | 0 | 0 | 0 | 106.9 | T89 | I87-T89 PolarHBondContact O-N 3.11Š|
| 88 | P | 32.1 | Very low | 37.1 | Very low | 111 Ų | 111 | 130.4 Ų | 130.4 | 72% | 0.721 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 124.4 | 168.7 | -15.2 | 28.5 | 0 | 0 | 0 | 107.9 | M90 | P88-M90 PolarHBondContact O-N 3.07Š|
| 89 | T | 34 | Very low | 38.1 | Very low | 129 Ų | 129 | 134.4 Ų | 134.4 | 79% | 0.791 | 75% | 0.747 | S | S | * | * | trans | -54.1 | 111.8 | 170.9 | 42.1 | 0 | 0 | 0 | 0 | 108.4 | I87 K91 | I87-T89 PolarHBondContact O-N 3.11Å; T89-K91 PolarHBondContact O-N 2.93Å | ||
| 90 | M | 35.7 | Very low | 38.7 | Very low | 185 Ų | 185 | 132.8 Ų | 132.8 | 91% | 0.911 | 74% | 0.739 | S | S | * | * | trans | -63.5 | 107.9 | 166.4 | -79.3 | -166.9 | 157.7 | 0 | 0 | 106.6 | P88 D92 | P88-M90 PolarHBondContact O-N 3.07Å; M90-D92 PolarHBondContact O-N 3.4Å; M90-D92 VanDerWaalsContact O-N 3.16Å | ||
| 91 | K | 36.2 | Very low | 38.9 | Very low | 182 Ų | 182 | 132.7 Ų | 132.7 | 79% | 0.791 | 73% | 0.728 | S | S | * | * | trans | -65.6 | 108.1 | 162.2 | -76.6 | -177.9 | 173.8 | -176.8 | 0 | 106.9 | T89 N93 | T89-K91 PolarHBondContact O-N 2.93Å; K91-N93 PolarHBondContact O-N 2.84Å | ||
| 92 | D | 35.2 | Very low | 39.3 | Very low | 152 Ų | 152 | 131.6 Ų | 131.6 | 81% | 0.813 | 72% | 0.718 | S | S | * | * | trans | 15.8 | 88.2 | 149.8 | -48.7 | -38.4 | 0 | 0 | 0 | 115.8 | M90 | M90-D92 PolarHBondContact O-N 3.4Å; M90-D92 VanDerWaalsContact O-N 3.16Å | ||
| 93 | N | 41.1 | Very low | 39.6 | Very low | 163 Ų | 163 | 133.2 Ų | 133.2 | 87% | 0.872 | 71% | 0.714 | S | S | * | * | trans | -93.1 | 85.1 | 152.4 | -73.8 | -22.6 | 0 | 0 | 0 | 106.6 | K91 A95 | K91-N93 PolarHBondContact O-N 2.84Å; N93-A95 PolarHBondContact O-N 3.23Å | ||
| 94 | A | 39.4 | Very low | 40.4 | Very low | 73 Ų | 73 | 131.5 Ų | 131.5 | 60% | 0.603 | 71% | 0.71 | S | S | * | * | trans | -64.8 | 124.7 | 172 | 0 | 0 | 0 | 0 | 0 | 108.9 | I96 | A94-I96 PolarHBondContact O-N 3.11Å; A94-I96 VanDerWaalsContact O-N 3.15Å | ||
| 95 | A | 39.2 | Very low | 40.8 | Very low | 68 Ų | 68 | 131.3 Ų | 131.3 | 56% | 0.562 | 70% | 0.704 | S | S | * | * | trans | -64.8 | 112.9 | 169.8 | 0 | 0 | 0 | 0 | 0 | 108.5 | N93 R103 | N93-A95 PolarHBondContact O-N 3.23Å; A95-R103 PolarHBondContact O-N 3.28Å | ||
| 96 | I | 49.7 | Very low | 41 | Very low | 130 Ų | 130 | 129.5 Ų | 129.5 | 67% | 0.667 | 70% | 0.701 | S | S | * | * | B | Isolated β-bridge | trans | -88.3 | 135.1 | 175.4 | 9.7 | 168.8 | 0 | 0 | 0 | 108.3 | A94 | A94-I96 PolarHBondContact O-N 3.11Å; A94-I96 VanDerWaalsContact O-N 3.15Å |
| 97 | D | 50.9 | Low | 41.4 | Very low | 64 Ų | 64 | 126.2 Ų | 126.2 | 34% | 0.342 | 68% | 0.684 | S | S | . | * | trans | -76.7 | 174.2 | 172.7 | 73 | 8.6 | 0 | 0 | 0 | 112 | K99 G100 E101 | D97-K99 PolarHBondContact O-N 3.37Å; D97-K99 VanDerWaalsContact OD1-C 3.31Å; D97-K99 WeakPolarHBondContact OD1-CA 3.26Å; D97-K99 WeakPolarHBondContact OD1-CB 3.47Å; D97-K99 PolarHBondContact OD1-N 3.36Å; D97-G100 PolarHBondContact O-N 3.49Å; D97-G100 PolarHBondContact OD1-N 3.33Å; D97-E101 PolarHBondContact N-O 3.22Å; D97-E101 PolarHBondContact OD1-N 2.88Å | ||
| 98 | E | 52.6 | Low | 41.9 | Very low | 209 Ų | 209 | 123.7 Ų | 123.7 | 98% | 0.977 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.2 | -3.6 | 179.2 | -59.3 | -175.1 | 171.9 | 0 | 0 | 113.8 | ||
| 99 | K | 54.9 | Low | 42.3 | Very low | 188 Ų | 188 | 125.3 Ų | 125.3 | 82% | 0.817 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.1 | 1.4 | 177.1 | -64.4 | -176.8 | 179.9 | 178.3 | 0 | 113.2 | D97 E101 | D97-K99 PolarHBondContact O-N 3.37Å; D97-K99 VanDerWaalsContact OD1-C 3.31Å; D97-K99 WeakPolarHBondContact OD1-CA 3.26Å; D97-K99 WeakPolarHBondContact OD1-CB 3.47Å; D97-K99 PolarHBondContact OD1-N 3.36Å; K99-E101 VanDerWaalsContact C-N 3.3Å |
| 100 | G | 46.9 | Very low | 42.4 | Very low | 53 Ų | 53 | 127.9 Ų | 127.9 | 55% | 0.546 | 67% | 0.667 | S | S | . | * | S | Bend | trans | 75.9 | 15.4 | -180 | 0 | 0 | 0 | 0 | 0 | 114.2 | D97 | D97-G100 PolarHBondContact O-N 3.49Å; D97-G100 PolarHBondContact OD1-N 3.33Å |
| 101 | E | 42.4 | Very low | 42.7 | Very low | 125 Ų | 125 | 125.1 Ų | 125.1 | 58% | 0.584 | 65% | 0.649 | S | S | * | * | trans | -94.8 | 144 | 176.5 | -72.3 | -80.1 | 149.8 | 0 | 0 | 110.3 | D97 K99 R103 | D97-E101 PolarHBondContact N-O 3.22Å; D97-E101 PolarHBondContact OD1-N 2.88Å; K99-E101 VanDerWaalsContact C-N 3.3Å; E101-R103 PolarHBondContact O-N 3.2Å | ||
| 102 | P | 41.4 | Very low | 43.2 | Very low | 86 Ų | 86 | 120.9 Ų | 120.9 | 56% | 0.558 | 64% | 0.639 | S | S | * | * | B | Isolated β-bridge | trans | -68.4 | 128 | 177.4 | -11.1 | 25.9 | 0 | 0 | 0 | 110.7 | E104 | P102-E104 PolarHBondContact O-N 3.32Å |
| 103 | R | 42.9 | Very low | 43.3 | Very low | 158 Ų | 158 | 120.1 Ų | 120.1 | 60% | 0.596 | 63% | 0.63 | S | S | * | * | trans | -66.4 | 103.5 | 170.9 | -114 | -176.8 | 169.9 | 178.1 | 1.3 | 110.7 | A95 E101 D105 | A95-R103 PolarHBondContact O-N 3.28Å; E101-R103 PolarHBondContact O-N 3.2Å; R103-D105 IonicContact NE-OD2 3.58Å; R103-D105 PolarHBondContact O-N 3.05Å | ||
| 104 | E | 48.4 | Very low | 43.3 | Very low | 166 Ų | 166 | 115 Ų | 115 | 78% | 0.776 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71 | -10.2 | 178.6 | -71.3 | -167.5 | 145.3 | 0 | 0 | 113.7 | P102 | P102-E104 PolarHBondContact O-N 3.32Š|
| 105 | D | 41.8 | Very low | 43.4 | Very low | 110 Ų | 110 | 118.2 Ų | 118.2 | 59% | 0.588 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.9 | -16.5 | -168.1 | 17.7 | -44.5 | 0 | 0 | 0 | 113.4 | R103 | R103-D105 IonicContact NE-OD2 3.58Å; R103-D105 PolarHBondContact O-N 3.05Å |
| 106 | C | 36 | Very low | 43.6 | Very low | 93 Ų | 93 | 118.5 Ų | 118.5 | 63% | 0.628 | 61% | 0.606 | S | S | * | * | S | Bend | trans | -95.9 | -10.5 | -178.1 | -144.1 | 0 | 0 | 0 | 0 | 113.9 | ||
| 107 | A | 38.2 | Very low | 43.1 | Very low | 52 Ų | 52 | 116.6 Ų | 116.6 | 43% | 0.43 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -88.8 | -16.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | K111 | A107-K111 WeakPolarHBondContact O-CG 3.17Å |
| 108 | N | 41.6 | Very low | 42.9 | Very low | 100 Ų | 100 | 117.5 Ų | 117.5 | 54% | 0.535 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -91.8 | -26.5 | -175.7 | -78.9 | -25.1 | 0 | 0 | 0 | 113.4 | K111 V112 | N108-K111 PolarHBondContact O-N 3.2Å; N108-V112 WeakPolarHBondContact O-CG2 3.42Å; N108-V112 PolarHBondContact O-N 2.83Å; N108-V112 VanDerWaalsContact O-N 3.09Å |
| 109 | E | 38.8 | Very low | 42.5 | Very low | 146 Ų | 146 | 115.4 Ų | 115.4 | 68% | 0.682 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -65.7 | -43.8 | 175.1 | -122.1 | 170.3 | -178.4 | 0 | 0 | 111.4 | K111 V112 E113 | E109-K111 VanDerWaalsContact C-N 3.32Å; E109-K111 PolarHBondContact O-N 3.03Å; E109-V112 PolarHBondContact O-N 2.87Å; E109-E113 PolarHBondContact O-N 3.22Å; E109-E113 VanDerWaalsContact O-N 3.14Å |
| 110 | Y | 37.4 | Very low | 41.9 | Very low | 183 Ų | 183 | 111.4 Ų | 111.4 | 72% | 0.718 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -67.4 | -30.3 | 176.7 | -165.1 | -100.1 | 0 | 0 | 0 | 113.2 | A114 | Y110-A114 VanDerWaalsContact O-CB 3.22Å; Y110-A114 WeakPolarHBondContact O-CB 3.45Å; Y110-A114 PolarHBondContact O-N 3.35Å |
| 111 | K | 41.5 | Very low | 41.5 | Very low | 126 Ų | 126 | 118 Ų | 118 | 55% | 0.548 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -77 | -27 | 176.4 | -76.8 | 177.3 | -178.1 | 171.6 | 0 | 112.9 | A107 N108 E109 K115 | A107-K111 WeakPolarHBondContact O-CG 3.17Å; N108-K111 PolarHBondContact O-N 3.2Å; E109-K111 VanDerWaalsContact C-N 3.32Å; E109-K111 PolarHBondContact O-N 3.03Å; K111-K115 VanDerWaalsContact O-CB 3.31Å; K111-K115 WeakPolarHBondContact O-CB 3.13Å; K111-K115 VanDerWaalsContact O-CG 3.25Å; K111-K115 WeakPolarHBondContact O-CG 3.11Å; K111-K115 PolarHBondContact O-N 3.24Å; K111-K115 VanDerWaalsContact O-N 3.1Å |
| 112 | V | 46.2 | Very low | 41.6 | Very low | 94 Ų | 94 | 115.7 Ų | 115.7 | 57% | 0.57 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -78.2 | -38.8 | 176.4 | 176 | 0 | 0 | 0 | 0 | 110.5 | N108 E109 K115 T116 | N108-V112 WeakPolarHBondContact O-CG2 3.42Å; N108-V112 PolarHBondContact O-N 2.83Å; N108-V112 VanDerWaalsContact O-N 3.09Å; E109-V112 PolarHBondContact O-N 2.87Å; V112-K115 PolarHBondContact O-N 3.08Å; V112-T116 WeakPolarHBondContact O-CG2 3.47Å; V112-T116 PolarHBondContact O-N 3.47Å; V112-T116 VanDerWaalsContact O-N 3.08Å; V112-T116 PolarHBondContact O-OG1 3.43Å; V112-T116 VanDerWaalsContact O-OG1 3.08Å |
| 113 | E | 37.4 | Very low | 41.7 | Very low | 136 Ų | 136 | 115.8 Ų | 115.8 | 64% | 0.636 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -69.2 | -37.1 | 172.6 | -71.5 | -172.6 | 154.1 | 0 | 0 | 112.9 | E109 T116 C117 | E109-E113 PolarHBondContact O-N 3.22Å; E109-E113 VanDerWaalsContact O-N 3.14Å; E113-T116 WeakPolarHBondContact CA-OG1 3.11Å; E113-T116 PolarHBondContact O-OG1 3.03Å; E113-C117 PolarHBondContact O-N 3.26Å; E113-C117 PolarHBondContact O-SG 3.29Å |
| 114 | A | 42 | Very low | 42 | Very low | 55 Ų | 55 | 115.9 Ų | 115.9 | 46% | 0.455 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -70.9 | -32.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y110 A118 | Y110-A114 VanDerWaalsContact O-CB 3.22Å; Y110-A114 WeakPolarHBondContact O-CB 3.45Å; Y110-A114 PolarHBondContact O-N 3.35Å; A114-A118 PolarHBondContact O-N 3.38Å |
| 115 | K | 41.9 | Very low | 42.3 | Very low | 141 Ų | 141 | 115.6 Ų | 115.6 | 61% | 0.613 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -73.2 | -37.7 | 175.7 | -82.1 | 179.7 | 176.7 | -175.5 | 0 | 112.8 | K111 V112 C117 A118 E119 | K111-K115 VanDerWaalsContact O-CB 3.31Å; K111-K115 WeakPolarHBondContact O-CB 3.13Å; K111-K115 VanDerWaalsContact O-CG 3.25Å; K111-K115 WeakPolarHBondContact O-CG 3.11Å; K111-K115 PolarHBondContact O-N 3.24Å; K111-K115 VanDerWaalsContact O-N 3.1Å; V112-K115 PolarHBondContact O-N 3.08Å; K115-C117 PolarHBondContact O-N 3.41Å; K115-A118 PolarHBondContact O-N 3.28Å; K115-A118 VanDerWaalsContact O-N 3.1Å; K115-E119 PolarHBondContact O-N 3.47Å |
| 116 | T | 44 | Very low | 42.7 | Very low | 74 Ų | 74 | 117.4 Ų | 117.4 | 45% | 0.454 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -66.1 | -25.1 | 175.4 | 50.9 | 0 | 0 | 0 | 0 | 112.5 | V112 E113 I120 | V112-T116 WeakPolarHBondContact O-CG2 3.47Å; V112-T116 PolarHBondContact O-N 3.47Å; V112-T116 VanDerWaalsContact O-N 3.08Å; V112-T116 PolarHBondContact O-OG1 3.43Å; V112-T116 VanDerWaalsContact O-OG1 3.08Å; E113-T116 WeakPolarHBondContact CA-OG1 3.11Å; E113-T116 PolarHBondContact O-OG1 3.03Å; T116-I120 VanDerWaalsContact O-CD1 3.23Å; T116-I120 WeakPolarHBondContact O-CD1 3.37Å; T116-I120 VanDerWaalsContact O-CG1 3.22Å; T116-I120 WeakPolarHBondContact O-CG1 3.19Å |
| 117 | C | 39.2 | Very low | 43.5 | Very low | 90 Ų | 90 | 122 Ų | 122 | 61% | 0.608 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -80.6 | -17.3 | 173.4 | -64.7 | 0 | 0 | 0 | 0 | 114.2 | E113 K115 | E113-C117 PolarHBondContact O-N 3.26Å; E113-C117 PolarHBondContact O-SG 3.29Å; K115-C117 PolarHBondContact O-N 3.41Å |
| 118 | A | 44.8 | Very low | 44 | Very low | 83 Ų | 83 | 123.1 Ų | 123.1 | 69% | 0.686 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -92 | -23 | -179 | 0 | 0 | 0 | 0 | 0 | 113.4 | A114 K115 | A114-A118 PolarHBondContact O-N 3.38Å; K115-A118 PolarHBondContact O-N 3.28Å; K115-A118 VanDerWaalsContact O-N 3.1Å |
| 119 | E | 44.5 | Very low | 44.8 | Very low | 165 Ų | 165 | 128.1 Ų | 128.1 | 77% | 0.771 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -96.6 | -9.5 | 179.5 | -68.1 | 175.8 | 178.2 | 0 | 0 | 113.3 | K115 | K115-E119 PolarHBondContact O-N 3.47Å |
| 120 | I | 43.4 | Very low | 45.7 | Very low | 103 Ų | 103 | 130.8 Ų | 130.8 | 53% | 0.528 | 65% | 0.65 | S | S | . | * | S | Bend | trans | -90.3 | 106.6 | 165.5 | -53.7 | 166 | 0 | 0 | 0 | 105.8 | T116 V122 | T116-I120 VanDerWaalsContact O-CD1 3.23Å; T116-I120 WeakPolarHBondContact O-CD1 3.37Å; T116-I120 VanDerWaalsContact O-CG1 3.22Å; T116-I120 WeakPolarHBondContact O-CG1 3.19Å; I120-V122 HydrophobicContact CG2-CB 4.48Å; I120-V122 HydrophobicContact CG2-CG1 3.67Å; I120-V122 PolarHBondContact O-N 3.21Å |
| 121 | E | 38.9 | Very low | 47.2 | Very low | 191 Ų | 191 | 126.7 Ų | 126.7 | 89% | 0.893 | 64% | 0.64 | S | S | * | * | trans | -63.3 | 68.2 | 162.6 | -67.6 | -172.1 | 167.9 | 0 | 0 | 109.3 | N123 | E121-N123 PolarHBondContact O-N 2.9Š| ||
| 122 | V | 44.5 | Very low | 48.7 | Very low | 78 Ų | 78 | 124.2 Ų | 124.2 | 47% | 0.473 | 63% | 0.632 | S | S | . | * | trans | -68.6 | 92 | 164.1 | -85.4 | 0 | 0 | 0 | 0 | 105.7 | I120 F124 | I120-V122 HydrophobicContact CG2-CB 4.48Å; I120-V122 HydrophobicContact CG2-CG1 3.67Å; I120-V122 PolarHBondContact O-N 3.21Å; V122-F124 HydrophobicContact CB-CD2 4.37Å; V122-F124 HydrophobicContact CB-CE2 4.11Å; V122-F124 HydrophobicContact CB-CZ 4.49Å; V122-F124 HydrophobicContact CG2-CD2 3.99Å; V122-F124 HydrophobicContact CG2-CE2 3.36Å; V122-F124 HydrophobicContact CG2-CZ 3.87Å; V122-F124 WeakPolarHBondContact O-CD2 3.38Å; V122-F124 PolarHBondContact O-N 3.36Å | ||
| 123 | N | 42.3 | Very low | 50.2 | Low | 87 Ų | 87 | 119.7 Ų | 119.7 | 47% | 0.465 | 61% | 0.605 | S | S | . | * | trans | -61.4 | 87 | 170.2 | -169 | -37.9 | 0 | 0 | 0 | 108.1 | E121 D125 Q126 | E121-N123 PolarHBondContact O-N 2.9Å; N123-D125 PolarHBondContact O-N 3Å; N123-D125 WeakPolarHBondContact OD1-CA 3.18Å; N123-D125 VanDerWaalsContact OD1-CB 3.31Å; N123-D125 WeakPolarHBondContact OD1-CB 3.34Å; N123-D125 PolarHBondContact OD1-N 3.23Å; N123-Q126 HydrophobicContact CB-CG 4.02Å; N123-Q126 PolarHBondContact O-N 3.37Å; N123-Q126 PolarHBondContact OD1-N 3.32Å | ||
| 124 | F | 49.9 | Very low | 52.1 | Low | 161 Ų | 161 | 119.6 Ų | 119.6 | 71% | 0.706 | 61% | 0.605 | S | S | * | * | G | 310 helix | trans | -60.8 | -15.5 | 178.6 | -78.1 | -83.5 | 0 | 0 | 0 | 112.1 | V122 | V122-F124 HydrophobicContact CB-CD2 4.37Å; V122-F124 HydrophobicContact CB-CE2 4.11Å; V122-F124 HydrophobicContact CB-CZ 4.49Å; V122-F124 HydrophobicContact CG2-CD2 3.99Å; V122-F124 HydrophobicContact CG2-CE2 3.36Å; V122-F124 HydrophobicContact CG2-CZ 3.87Å; V122-F124 WeakPolarHBondContact O-CD2 3.38Å; V122-F124 PolarHBondContact O-N 3.36Å |
| 125 | D | 55.2 | Low | 53.5 | Low | 160 Ų | 160 | 121.5 Ų | 121.5 | 86% | 0.856 | 60% | 0.603 | S | S | * | * | G | 310 helix | trans | -81.5 | -6.4 | 174.1 | -78.5 | -28 | 0 | 0 | 0 | 114 | N123 R127 | N123-D125 PolarHBondContact O-N 3Å; N123-D125 WeakPolarHBondContact OD1-CA 3.18Å; N123-D125 VanDerWaalsContact OD1-CB 3.31Å; N123-D125 WeakPolarHBondContact OD1-CB 3.34Å; N123-D125 PolarHBondContact OD1-N 3.23Å; D125-R127 PolarHBondContact O-N 2.83Å |
| 126 | Q | 50.4 | Low | 55.2 | Low | 147 Ų | 147 | 116.3 Ų | 116.3 | 69% | 0.687 | 58% | 0.584 | S | S | * | * | G | 310 helix | trans | -86.2 | 18.4 | 168.7 | -70.4 | -176.1 | 20.9 | 0 | 0 | 113.6 | N123 P128 | N123-Q126 HydrophobicContact CB-CG 4.02Å; N123-Q126 PolarHBondContact O-N 3.37Å; N123-Q126 PolarHBondContact OD1-N 3.32Å; Q126-P128 VanDerWaalsContact O-CD 3.31Å; Q126-P128 WeakPolarHBondContact O-CD 3.06Å |
| 127 | R | 52.5 | Low | 56.8 | Low | 189 Ų | 189 | 118.7 Ų | 118.7 | 71% | 0.713 | 59% | 0.594 | S | S | * | * | S | Bend | trans | -58.8 | 116.4 | 170.1 | -155.1 | -178.4 | -80 | -168.7 | -6.2 | 107.1 | D125 K129 | D125-R127 PolarHBondContact O-N 2.83Å; R127-K129 PolarHBondContact O-N 3.28Å; R127-K129 VanDerWaalsContact O-N 3.13Å |
| 128 | P | 48.9 | Very low | 58.6 | Low | 76 Ų | 76 | 115.6 Ų | 115.6 | 49% | 0.494 | 58% | 0.577 | S | S | . | * | trans | -53.8 | 126.4 | -168.7 | 15.1 | -27.9 | 0 | 0 | 0 | 109.8 | Q126 K130 I132 | Q126-P128 VanDerWaalsContact O-CD 3.31Å; Q126-P128 WeakPolarHBondContact O-CD 3.06Å; P128-K130 PolarHBondContact O-N 3.13Å; P128-I132 HydrophobicContact CB-CB 4.39Å; P128-I132 HydrophobicContact CB-CD1 3.51Å; P128-I132 HydrophobicContact CB-CG1 3.97Å; P128-I132 HydrophobicContact CG-CB 4.29Å; P128-I132 HydrophobicContact CG-CD1 4.08Å; P128-I132 HydrophobicContact CG-CG1 4.41Å | ||
| 129 | K | 56.9 | Low | 60.5 | Low | 205 Ų | 205 | 116.9 Ų | 116.9 | 89% | 0.891 | 58% | 0.576 | S | S | * | * | trans | -53.4 | 102.9 | -175.4 | -79.9 | 176.5 | 177.1 | 172.7 | 0 | 109.8 | R127 D131 | R127-K129 PolarHBondContact O-N 3.28Å; R127-K129 VanDerWaalsContact O-N 3.13Å; K129-D131 PolarHBondContact O-N 3.02Å | ||
| 130 | K | 59 | Low | 62.3 | Low | 202 Ų | 202 | 112 Ų | 112 | 88% | 0.878 | 57% | 0.57 | S | S | * | * | S | Bend | trans | 59.9 | -6.8 | 152.9 | -98 | 177.5 | 178.5 | 177.9 | 0 | 123.1 | P128 | P128-K130 PolarHBondContact O-N 3.13Š|
| 131 | D | 67.4 | Low | 64.1 | Low | 97 Ų | 97 | 109.2 Ų | 109.2 | 52% | 0.519 | 56% | 0.555 | S | S | . | * | trans | -138.6 | 17.7 | -178.5 | -74.3 | -48.8 | 0 | 0 | 0 | 116.3 | K129 T139 G140 | K129-D131 PolarHBondContact O-N 3.02Å; D131-T139 CarbonylContact O-C 3.24Å; D131-T139 VanDerWaalsContact O-C 3.24Å; D131-T139 WeakPolarHBondContact O-CA 2.86Å; D131-G140 PolarHBondContact O-N 2.96Å | ||
| 132 | I | 74.2 | Confident | 66 | Low | 74 Ų | 74 | 102.9 Ų | 102.9 | 38% | 0.379 | 53% | 0.531 | S | S | . | . | B | Isolated β-bridge | trans | -98.8 | 125.7 | 175.7 | -49.3 | -170.5 | 0 | 0 | 0 | 111 | P128 G138 T139 | P128-I132 HydrophobicContact CB-CB 4.39Å; P128-I132 HydrophobicContact CB-CD1 3.51Å; P128-I132 HydrophobicContact CB-CG1 3.97Å; P128-I132 HydrophobicContact CG-CB 4.29Å; P128-I132 HydrophobicContact CG-CD1 4.08Å; P128-I132 HydrophobicContact CG-CG1 4.41Å; I132-G138 WeakPolarHBondContact CA-O 3.44Å; I132-T139 HydrophobicContact CG1-CG2 4.16Å |
| 133 | C | 77.4 | Confident | 67.5 | Low | 0 Ų | 0 | 102.3 Ų | 102.3 | 0% | 0 | 52% | 0.524 | C | S | . | . | trans | -71.7 | 124.9 | 174.5 | 172.7 | 0 | 0 | 0 | 0 | 111.5 | F135 C136 N137 G138 H141 C146 | C133-F135 PolarHBondContact O-N 2.92Å; C133-F135 PolarHBondContact SG-N 3.08Å; C133-C136 PolarHBondContact SG-N 3.43Å; C133-N137 WeakPolarHBondContact O-CA 3.31Å; C133-N137 PolarHBondContact O-N 3.27Å; C133-G138 WeakPolarHBondContact CB-O 3.42Å; C133-G138 PolarHBondContact N-O 3.41Å; C133-H141 WeakPolarHBondContact CB-NE2 3.4Å; C133-H141 PolarHBondContact N-O 3.44Å; C133-H141 PolarHBondContact SG-NE2 3.28Å; C133-H141 VanDerWaalsContact SG-NE2 3.42Å; C133-C146 WeakPolarHBondContact SG-CB 3.46Å; C133-C146 PolarHBondContact SG-SG 3.3Å | ||
| 134 | Q | 76.5 | Confident | 68.9 | Low | 134 Ų | 134 | 106.4 Ų | 106.4 | 63% | 0.626 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.5 | -9.6 | 179.3 | -64.3 | 178.7 | -14.4 | 0 | 0 | 115 | H143 | Q134-H143 HydrophobicContact CB-CB 4.32Š|
| 135 | F | 71.1 | Confident | 69.9 | Low | 95 Ų | 95 | 102.5 Ų | 102.5 | 42% | 0.417 | 53% | 0.525 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.9 | -49.7 | 179.2 | -179.9 | -91.1 | 0 | 0 | 0 | 112.3 | C133 Q148 L149 | C133-F135 PolarHBondContact O-N 2.92Å; C133-F135 PolarHBondContact SG-N 3.08Å; F135-Q148 HydrophobicContact CD1-CB 4.35Å; F135-Q148 HydrophobicContact CE1-CB 4.19Å; F135-Q148 WeakPolarHBondContact CE1-O 3.03Å; F135-L149 HydrophobicContact CB-CD2 3.81Å; F135-L149 HydrophobicContact CB-CG 4.31Å; F135-L149 HydrophobicContact CD1-CD2 3.83Å; F135-L149 HydrophobicContact CD1-CG 4.07Å; F135-L149 HydrophobicContact CD2-CD2 3.32Å; F135-L149 HydrophobicContact CD2-CG 4.4Å; F135-L149 HydrophobicContact CE1-CD2 4.25Å; F135-L149 HydrophobicContact CE2-CD2 3.77Å; F135-L149 HydrophobicContact CG-CD2 3.35Å; F135-L149 HydrophobicContact CG-CG 4Å; F135-L149 HydrophobicContact CZ-CD2 4.21Å |
| 136 | C | 79.3 | Confident | 70.9 | Confident | 32 Ų | 32 | 95.3 Ų | 95.3 | 22% | 0.216 | 49% | 0.487 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -104.8 | -3.2 | -178.1 | 69 | 0 | 0 | 0 | 0 | 114.7 | C133 G138 H141 C146 Q148 | C133-C136 PolarHBondContact SG-N 3.43Å; C136-G138 PolarHBondContact O-N 3.32Å; C136-G138 PolarHBondContact SG-N 3.01Å; C136-H141 PolarHBondContact SG-CE1 2.96Å; C136-H141 PolarHBondContact SG-NE2 3.07Å; C136-C146 PolarHBondContact SG-SG 3.07Å; C136-Q148 HydrophobicContact CB-CB 4.14Å; C136-Q148 HydrophobicContact CB-CG 4.31Å |
| 137 | N | 76.6 | Confident | 72 | Confident | 124 Ų | 124 | 97.7 Ų | 97.7 | 66% | 0.663 | 50% | 0.499 | S | S | * | . | trans | 57 | 12.1 | -171.5 | -63.4 | -20.4 | 0 | 0 | 0 | 115.1 | C133 | C133-N137 WeakPolarHBondContact O-CA 3.31Å; C133-N137 PolarHBondContact O-N 3.27Å | ||
| 138 | G | 77.5 | Confident | 72.7 | Confident | 24 Ų | 24 | 94.6 Ų | 94.6 | 25% | 0.247 | 49% | 0.492 | C | S | . | . | trans | -73 | 151.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | I132 C133 C136 | I132-G138 WeakPolarHBondContact CA-O 3.44Å; C133-G138 WeakPolarHBondContact CB-O 3.42Å; C133-G138 PolarHBondContact N-O 3.41Å; C136-G138 PolarHBondContact O-N 3.32Å; C136-G138 PolarHBondContact SG-N 3.01Å | ||
| 139 | T | 84.4 | Confident | 73.7 | Confident | 110 Ų | 110 | 91.7 Ų | 91.7 | 68% | 0.675 | 47% | 0.472 | S | S | * | . | B | Isolated β-bridge | trans | -88.4 | 167.2 | 175.6 | 54.8 | 0 | 0 | 0 | 0 | 111.7 | D131 I132 H141 | D131-T139 CarbonylContact O-C 3.24Å; D131-T139 VanDerWaalsContact O-C 3.24Å; D131-T139 WeakPolarHBondContact O-CA 2.86Å; I132-T139 HydrophobicContact CG1-CG2 4.16Å; T139-H141 VanDerWaalsContact C-N 3.32Å; T139-H141 PolarHBondContact O-N 3.04Å; T139-H141 PolarHBondContact O-ND1 3.49Å |
| 140 | G | 81.9 | Confident | 74.3 | Confident | 62 Ų | 62 | 90 Ų | 90 | 64% | 0.639 | 47% | 0.465 | S | S | * | . | S | Bend | trans | 78.7 | 6.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | D131 | D131-G140 PolarHBondContact O-N 2.96Š|
| 141 | H | 81.5 | Confident | 75.1 | Confident | 45 Ų | 45 | 83.4 Ų | 83.4 | 21% | 0.208 | 44% | 0.439 | C | S | . | . | S | Bend | trans | -153 | 148.7 | 175.4 | 67.8 | -80.1 | 0 | 0 | 0 | 111.9 | C133 C136 T139 C146 | C133-H141 WeakPolarHBondContact CB-NE2 3.4Å; C133-H141 PolarHBondContact N-O 3.44Å; C133-H141 PolarHBondContact SG-NE2 3.28Å; C133-H141 VanDerWaalsContact SG-NE2 3.42Å; C136-H141 PolarHBondContact SG-CE1 2.96Å; C136-H141 PolarHBondContact SG-NE2 3.07Å; T139-H141 VanDerWaalsContact C-N 3.32Å; T139-H141 PolarHBondContact O-N 3.04Å; T139-H141 PolarHBondContact O-ND1 3.49Å; H141-C146 WeakPolarHBondContact CD2-CA 3.48Å; H141-C146 WeakPolarHBondContact NE2-CA 3.45Å; H141-C146 WeakPolarHBondContact NE2-CB 3.41Å; H141-C146 PolarHBondContact NE2-SG 3.25Å; H141-C146 VanDerWaalsContact NE2-SG 3.38Å |
| 142 | S | 79.5 | Confident | 75.9 | Confident | 58 Ų | 58 | 85.2 Ų | 85.2 | 41% | 0.406 | 44% | 0.442 | S | S | . | . | trans | -76.4 | 163.7 | 172.9 | 78.5 | 0 | 0 | 0 | 0 | 111.2 | R144 S145 C146 | S142-R144 PolarHBondContact O-N 2.75Å; S142-R144 WeakPolarHBondContact OG-CB 3.26Å; S142-R144 PolarHBondContact OG-N 2.95Å; S142-S145 PolarHBondContact O-N 3.18Å; S142-C146 PolarHBondContact O-N 2.68Å | ||
| 143 | H | 74.9 | Confident | 76.6 | Confident | 67 Ų | 67 | 81.8 Ų | 81.8 | 31% | 0.31 | 43% | 0.425 | S | S | . | . | G | 310 helix | trans | -44.7 | -41.4 | 168.2 | 177.5 | -148.4 | 0 | 0 | 0 | 111.2 | Q134 S145 C146 L149 | Q134-H143 HydrophobicContact CB-CB 4.32Å; H143-S145 VanDerWaalsContact C-N 3.25Å; H143-S145 PolarHBondContact O-N 2.86Å; H143-C146 WeakPolarHBondContact O-CB 3.49Å; H143-C146 PolarHBondContact O-N 3.43Å; H143-L149 WeakPolarHBondContact NE2-CD2 3.33Å; H143-L149 WeakPolarHBondContact O-CD1 3.1Å |
| 144 | R | 71.6 | Confident | 77.3 | Confident | 173 Ų | 173 | 89.9 Ų | 89.9 | 65% | 0.653 | 46% | 0.457 | S | S | * | . | G | 310 helix | trans | -65.7 | -22.1 | -179.1 | -51.7 | -174.8 | -176 | -152.1 | -0.8 | 114.9 | S142 | S142-R144 PolarHBondContact O-N 2.75Å; S142-R144 WeakPolarHBondContact OG-CB 3.26Å; S142-R144 PolarHBondContact OG-N 2.95Å |
| 145 | S | 71.6 | Confident | 77.9 | Confident | 79 Ų | 79 | 86.4 Ų | 86.4 | 55% | 0.552 | 44% | 0.441 | S | S | * | . | G | 310 helix | trans | -108.8 | 10.5 | -174.2 | -55.6 | 0 | 0 | 0 | 0 | 112.2 | S142 H143 Q147 | S142-S145 PolarHBondContact O-N 3.18Å; H143-S145 VanDerWaalsContact C-N 3.25Å; H143-S145 PolarHBondContact O-N 2.86Å; S145-Q147 PolarHBondContact O-N 2.85Å |
| 146 | C | 75.8 | Confident | 78.9 | Confident | 9 Ų | 9 | 82.9 Ų | 82.9 | 6% | 0.061 | 43% | 0.429 | C | S | . | . | trans | -76 | 112.7 | -176.1 | -176.1 | 0 | 0 | 0 | 0 | 111.4 | C133 C136 H141 S142 H143 Q148 L149 | C133-C146 WeakPolarHBondContact SG-CB 3.46Å; C133-C146 PolarHBondContact SG-SG 3.3Å; C136-C146 PolarHBondContact SG-SG 3.07Å; H141-C146 WeakPolarHBondContact CD2-CA 3.48Å; H141-C146 WeakPolarHBondContact NE2-CA 3.45Å; H141-C146 WeakPolarHBondContact NE2-CB 3.41Å; H141-C146 PolarHBondContact NE2-SG 3.25Å; H141-C146 VanDerWaalsContact NE2-SG 3.38Å; S142-C146 PolarHBondContact O-N 2.68Å; H143-C146 WeakPolarHBondContact O-CB 3.49Å; H143-C146 PolarHBondContact O-N 3.43Å; C146-Q148 PolarHBondContact O-N 2.83Å; C146-Q148 PolarHBondContact SG-N 3.44Å; C146-L149 HydrophobicContact CB-CD1 3.82Å; C146-L149 HydrophobicContact CB-CG 3.77Å; C146-L149 VanDerWaalsContact O-CB 3.3Å; C146-L149 WeakPolarHBondContact O-CB 3.31Å; C146-L149 PolarHBondContact O-N 3.29Å | ||
| 147 | Q | 74.2 | Confident | 79.4 | Confident | 197 Ų | 197 | 82.9 Ų | 82.9 | 92% | 0.921 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.6 | -21.4 | 175.6 | -63.8 | -179.4 | -4.6 | 0 | 0 | 112.7 | S145 L149 | S145-Q147 PolarHBondContact O-N 2.85Å; Q147-L149 VanDerWaalsContact C-N 3.29Å |
| 148 | Q | 67.7 | Low | 80 | Confident | 123 Ų | 123 | 80.5 Ų | 80.5 | 58% | 0.575 | 42% | 0.424 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.6 | -7.5 | 175.6 | -63.5 | -167.5 | -12 | 0 | 0 | 113.4 | F135 C136 C146 K150 | F135-Q148 HydrophobicContact CD1-CB 4.35Å; F135-Q148 HydrophobicContact CE1-CB 4.19Å; F135-Q148 WeakPolarHBondContact CE1-O 3.03Å; C136-Q148 HydrophobicContact CB-CB 4.14Å; C136-Q148 HydrophobicContact CB-CG 4.31Å; C146-Q148 PolarHBondContact O-N 2.83Å; C146-Q148 PolarHBondContact SG-N 3.44Å; Q148-K150 PolarHBondContact O-N 3.09Å |
| 149 | L | 69.3 | Low | 80.3 | Confident | 16 Ų | 16 | 87.2 Ų | 87.2 | 8% | 0.084 | 44% | 0.442 | C | S | . | . | trans | -64.5 | 83 | 171.9 | -77.4 | 167.7 | 0 | 0 | 0 | 109.9 | F135 H143 C146 Q147 L151 | F135-L149 HydrophobicContact CB-CD2 3.81Å; F135-L149 HydrophobicContact CB-CG 4.31Å; F135-L149 HydrophobicContact CD1-CD2 3.83Å; F135-L149 HydrophobicContact CD1-CG 4.07Å; F135-L149 HydrophobicContact CD2-CD2 3.32Å; F135-L149 HydrophobicContact CD2-CG 4.4Å; F135-L149 HydrophobicContact CE1-CD2 4.25Å; F135-L149 HydrophobicContact CE2-CD2 3.77Å; F135-L149 HydrophobicContact CG-CD2 3.35Å; F135-L149 HydrophobicContact CG-CG 4Å; F135-L149 HydrophobicContact CZ-CD2 4.21Å; H143-L149 WeakPolarHBondContact NE2-CD2 3.33Å; H143-L149 WeakPolarHBondContact O-CD1 3.1Å; C146-L149 HydrophobicContact CB-CD1 3.82Å; C146-L149 HydrophobicContact CB-CG 3.77Å; C146-L149 VanDerWaalsContact O-CB 3.3Å; C146-L149 WeakPolarHBondContact O-CB 3.31Å; C146-L149 PolarHBondContact O-N 3.29Å; Q147-L149 VanDerWaalsContact C-N 3.29Å; L149-L151 HydrophobicContact CB-CG 4.36Å; L149-L151 HydrophobicContact CD2-CD1 3.51Å; L149-L151 HydrophobicContact CD2-CG 3.64Å; L149-L151 HydrophobicContact CG-CD1 4.48Å; L149-L151 PolarHBondContact O-N 3Å | ||
| 150 | K | 69.2 | Low | 80.2 | Confident | 169 Ų | 169 | 85 Ų | 85 | 74% | 0.735 | 44% | 0.44 | S | S | * | . | trans | -72.5 | 62.8 | 154.6 | -61.2 | -177.1 | -176.8 | 179.3 | 0 | 106.4 | Q148 W159 | Q148-K150 PolarHBondContact O-N 3.09Å; K150-W159 VanDerWaalsContact C-CE3 3.47Å; K150-W159 VanDerWaalsContact C-CZ3 3.46Å; K150-W159 HydrophobicContact CB-CE3 3.9Å; K150-W159 HydrophobicContact CB-CZ3 3.75Å; K150-W159 WeakPolarHBondContact O-CZ3 3.22Å | ||
| 151 | L | 74.9 | Confident | 80.3 | Confident | 63 Ų | 63 | 84 Ų | 84 | 33% | 0.33 | 42% | 0.419 | S | S | . | . | P | Polyproline II helix | trans | -94.3 | 124.8 | 162.8 | -69.5 | -180 | 0 | 0 | 0 | 106.8 | L149 G160 P162 | L149-L151 HydrophobicContact CB-CG 4.36Å; L149-L151 HydrophobicContact CD2-CD1 3.51Å; L149-L151 HydrophobicContact CD2-CG 3.64Å; L149-L151 HydrophobicContact CG-CD1 4.48Å; L149-L151 PolarHBondContact O-N 3Å; L151-G160 PolarHBondContact O-N 2.94Å; L151-P162 HydrophobicContact CD1-CB 4.38Å |
| 152 | K | 84.5 | Confident | 80.4 | Confident | 136 Ų | 136 | 82.7 Ų | 82.7 | 59% | 0.591 | 42% | 0.415 | S | S | * | . | B | Isolated β-bridge | trans | -79.7 | 123.3 | 166.7 | -169.2 | 178.8 | -179.1 | -176.9 | 0 | 107.4 | Y154 G157 W159 | K152-Y154 PolarHBondContact O-N 3.33Å; K152-G157 WeakPolarHBondContact CE-O 3.13Å; K152-G157 VanDerWaalsContact CG-O 3.31Å; K152-G157 WeakPolarHBondContact CG-O 3.31Å; K152-W159 HydrophobicContact CB-CD2 4.28Å; K152-W159 HydrophobicContact CB-CE3 4.09Å; K152-W159 HydrophobicContact CB-CH2 4.21Å; K152-W159 HydrophobicContact CB-CZ2 4.37Å; K152-W159 HydrophobicContact CB-CZ3 4.05Å |
| 153 | C | 89.3 | Confident | 80.7 | Confident | 2 Ų | 2 | 80 Ų | 80 | 1% | 0.014 | 40% | 0.396 | C | S | . | . | P | Polyproline II helix | trans | -61.4 | 125 | 176.9 | 175.7 | 0 | 0 | 0 | 0 | 110.1 | I155 C156 G157 T158 H161 G163 | C153-I155 PolarHBondContact O-N 3.25Å; C153-I155 PolarHBondContact SG-N 3.02Å; C153-C156 WeakPolarHBondContact CB-SG 3.15Å; C153-C156 PolarHBondContact SG-N 3.47Å; C153-C156 VanDerWaalsContact SG-N 3.37Å; C153-C156 PolarHBondContact SG-SG 3.2Å; C153-G157 WeakPolarHBondContact O-CA 3.47Å; C153-G157 PolarHBondContact O-N 3.23Å; C153-T158 WeakPolarHBondContact CB-O 3.23Å; C153-T158 PolarHBondContact N-O 3.35Å; C153-H161 WeakPolarHBondContact CB-NE2 3.45Å; C153-H161 WeakPolarHBondContact CB-O 3.07Å; C153-H161 PolarHBondContact SG-NE2 3.1Å; C153-G163 VanDerWaalsContact SG-CA 3.59Å |
| 154 | Y | 91.6 | Very high | 81.1 | Confident | 170 Ų | 170 | 80.8 Ų | 80.8 | 67% | 0.667 | 40% | 0.397 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.4 | -5.8 | 177.8 | 63.5 | -98.6 | 0 | 0 | 0 | 113.6 | K152 | K152-Y154 PolarHBondContact O-N 3.33Š|
| 155 | I | 90.6 | Very high | 81.7 | Confident | 60 Ų | 60 | 75.8 Ų | 75.8 | 31% | 0.308 | 38% | 0.382 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.5 | -53.9 | 178.1 | -56.5 | -173.1 | 0 | 0 | 0 | 111.2 | C153 G163 C166 M168 R169 | C153-I155 PolarHBondContact O-N 3.25Å; C153-I155 PolarHBondContact SG-N 3.02Å; I155-G163 WeakPolarHBondContact CD1-O 3.49Å; I155-C166 HydrophobicContact CB-CB 4.08Å; I155-C166 HydrophobicContact CD1-CB 4.1Å; I155-C166 HydrophobicContact CG1-CB 4.48Å; I155-C166 HydrophobicContact CG2-CB 4.42Å; I155-M168 HydrophobicContact CG2-CB 4.31Å; I155-M168 WeakPolarHBondContact CG2-O 3.27Å; I155-R169 HydrophobicContact CD1-CB 3.83Å; I155-R169 HydrophobicContact CD1-CG 3.89Å |
| 156 | C | 91.2 | Very high | 82.4 | Confident | 22 Ų | 22 | 72.1 Ų | 72.1 | 15% | 0.149 | 36% | 0.357 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -102.5 | -10.8 | -176.5 | 66.5 | 0 | 0 | 0 | 0 | 114.5 | C153 T158 H161 M168 | C153-C156 WeakPolarHBondContact CB-SG 3.15Å; C153-C156 PolarHBondContact SG-N 3.47Å; C153-C156 VanDerWaalsContact SG-N 3.37Å; C153-C156 PolarHBondContact SG-SG 3.2Å; C156-T158 PolarHBondContact O-N 3.23Å; C156-T158 PolarHBondContact SG-N 3.26Å; C156-T158 PolarHBondContact SG-OG1 3.31Å; C156-H161 PolarHBondContact SG-CE1 3.08Å; C156-H161 PolarHBondContact SG-NE2 3.1Å; C156-M168 VanDerWaalsContact CA-CE 3.41Å; C156-M168 HydrophobicContact CB-CB 4.45Å; C156-M168 HydrophobicContact CB-CE 3.14Å; C156-M168 HydrophobicContact CB-CG 4.2Å; C156-M168 HydrophobicContact CB-SD 4.28Å |
| 157 | G | 90 | Very high | 83 | Confident | 31 Ų | 31 | 79.9 Ų | 79.9 | 32% | 0.32 | 39% | 0.392 | S | S | . | . | trans | 72.6 | 0.5 | -177.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | K152 C153 | K152-G157 WeakPolarHBondContact CE-O 3.13Å; K152-G157 VanDerWaalsContact CG-O 3.31Å; K152-G157 WeakPolarHBondContact CG-O 3.31Å; C153-G157 WeakPolarHBondContact O-CA 3.47Å; C153-G157 PolarHBondContact O-N 3.23Å | ||
| 158 | T | 88.2 | Confident | 83.6 | Confident | 74 Ų | 74 | 73.5 Ų | 73.5 | 45% | 0.454 | 36% | 0.363 | S | S | . | . | trans | -85.5 | 157.9 | 175.8 | 71.3 | 0 | 0 | 0 | 0 | 111.6 | C153 C156 H161 | C153-T158 WeakPolarHBondContact CB-O 3.23Å; C153-T158 PolarHBondContact N-O 3.35Å; C156-T158 PolarHBondContact O-N 3.23Å; C156-T158 PolarHBondContact SG-N 3.26Å; C156-T158 PolarHBondContact SG-OG1 3.31Å; T158-H161 PolarHBondContact OG1-CE1 3.31Å; T158-H161 VanDerWaalsContact OG1-CE1 3.23Å | ||
| 159 | W | 85.2 | Confident | 84.7 | Confident | 165 Ų | 165 | 71.1 Ų | 71.1 | 63% | 0.625 | 35% | 0.349 | S | S | * | . | B | Isolated β-bridge | trans | -86.8 | 160.5 | 177.6 | -60.9 | 91.7 | 0 | 0 | 0 | 111.1 | K150 K152 | K150-W159 VanDerWaalsContact C-CE3 3.47Å; K150-W159 VanDerWaalsContact C-CZ3 3.46Å; K150-W159 HydrophobicContact CB-CE3 3.9Å; K150-W159 HydrophobicContact CB-CZ3 3.75Å; K150-W159 WeakPolarHBondContact O-CZ3 3.22Å; K152-W159 HydrophobicContact CB-CD2 4.28Å; K152-W159 HydrophobicContact CB-CE3 4.09Å; K152-W159 HydrophobicContact CB-CH2 4.21Å; K152-W159 HydrophobicContact CB-CZ2 4.37Å; K152-W159 HydrophobicContact CB-CZ3 4.05Å |
| 160 | G | 82.1 | Confident | 85.6 | Confident | 63 Ų | 63 | 71.9 Ų | 71.9 | 65% | 0.649 | 36% | 0.358 | S | S | * | . | S | Bend | trans | 98.7 | -1.4 | 169.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | L151 | L151-G160 PolarHBondContact O-N 2.94Š|
| 161 | H | 82.8 | Confident | 86.5 | Confident | 41 Ų | 41 | 63.9 Ų | 63.9 | 19% | 0.19 | 32% | 0.323 | C | S | . | . | S | Bend | trans | -149.4 | 146.5 | 169 | 64.9 | -85.7 | 0 | 0 | 0 | 112.4 | C153 C156 T158 L165 C166 | C153-H161 WeakPolarHBondContact CB-NE2 3.45Å; C153-H161 WeakPolarHBondContact CB-O 3.07Å; C153-H161 PolarHBondContact SG-NE2 3.1Å; C156-H161 PolarHBondContact SG-CE1 3.08Å; C156-H161 PolarHBondContact SG-NE2 3.1Å; T158-H161 PolarHBondContact OG1-CE1 3.31Å; T158-H161 VanDerWaalsContact OG1-CE1 3.23Å; H161-L165 HydrophobicContact CB-CB 4.37Å; H161-C166 VanDerWaalsContact CD2-CA 3.45Å; H161-C166 WeakPolarHBondContact CD2-CA 2.94Å; H161-C166 WeakPolarHBondContact NE2-CA 3.37Å |
| 162 | P | 83.5 | Confident | 86.9 | Confident | 19 Ų | 19 | 65 Ų | 65 | 12% | 0.123 | 33% | 0.329 | C | S | . | . | trans | -73.4 | 154.2 | 168.7 | 32.3 | -35.2 | 0 | 0 | 0 | 110.4 | L151 Y164 L165 C166 | L151-P162 HydrophobicContact CD1-CB 4.38Å; P162-Y164 HydrophobicContact CB-CD1 3.66Å; P162-Y164 HydrophobicContact CB-CE1 3.38Å; P162-Y164 HydrophobicContact CG-CD1 3.73Å; P162-Y164 HydrophobicContact CG-CE1 3.17Å; P162-Y164 HydrophobicContact CG-CE2 4.15Å; P162-Y164 HydrophobicContact CG-CG 4.39Å; P162-Y164 PolarHBondContact O-N 3.47Å; P162-L165 HydrophobicContact CG-CB 4.32Å; P162-L165 HydrophobicContact CG-CD1 3.96Å; P162-L165 HydrophobicContact CG-CG 4.07Å; P162-L165 PolarHBondContact O-N 3.08Å; P162-C166 PolarHBondContact O-N 2.96Å | ||
| 163 | G | 86.1 | Confident | 86.8 | Confident | 0 Ų | 0 | 59.3 Ų | 59.3 | 0% | 0 | 31% | 0.305 | C | S | . | . | G | 310 helix | trans | -59.5 | -22.1 | -175.3 | 0 | 0 | 0 | 0 | 0 | 115 | C153 I155 L165 C166 | C153-G163 VanDerWaalsContact SG-CA 3.59Å; I155-G163 WeakPolarHBondContact CD1-O 3.49Å; G163-L165 VanDerWaalsContact C-N 3.26Å; G163-L165 PolarHBondContact O-N 3.14Å; G163-C166 VanDerWaalsContact O-CB 3.26Å; G163-C166 WeakPolarHBondContact O-CB 3.29Å; G163-C166 PolarHBondContact O-N 3.43Å |
| 164 | Y | 83.6 | Confident | 86.6 | Confident | 84 Ų | 84 | 59.5 Ų | 59.5 | 33% | 0.329 | 31% | 0.306 | S | S | . | . | G | 310 helix | trans | -72.2 | -17.1 | 174.5 | 71.4 | -94.3 | 0 | 0 | 0 | 114.8 | P162 R169 | P162-Y164 HydrophobicContact CB-CD1 3.66Å; P162-Y164 HydrophobicContact CB-CE1 3.38Å; P162-Y164 HydrophobicContact CG-CD1 3.73Å; P162-Y164 HydrophobicContact CG-CE1 3.17Å; P162-Y164 HydrophobicContact CG-CE2 4.15Å; P162-Y164 HydrophobicContact CG-CG 4.39Å; P162-Y164 PolarHBondContact O-N 3.47Å; Y164-R169 VanDerWaalsContact CA-NH1 3.28Å; Y164-R169 VanDerWaalsContact CB-NH1 3.33Å |
| 165 | L | 83.7 | Confident | 86.3 | Confident | 68 Ų | 68 | 55.1 Ų | 55.1 | 36% | 0.356 | 29% | 0.291 | S | S | . | . | G | 310 helix | trans | -102.2 | 5.5 | 172.2 | -63.4 | 179.1 | 0 | 0 | 0 | 112.6 | H161 P162 G163 E167 | H161-L165 HydrophobicContact CB-CB 4.37Å; P162-L165 HydrophobicContact CG-CB 4.32Å; P162-L165 HydrophobicContact CG-CD1 3.96Å; P162-L165 HydrophobicContact CG-CG 4.07Å; P162-L165 PolarHBondContact O-N 3.08Å; G163-L165 VanDerWaalsContact C-N 3.26Å; G163-L165 PolarHBondContact O-N 3.14Å; L165-E167 PolarHBondContact O-N 3.42Å |
| 166 | C | 87.8 | Confident | 86 | Confident | 3 Ų | 3 | 55 Ų | 55 | 2% | 0.02 | 29% | 0.293 | C | S | . | . | trans | -66.9 | 128.5 | -179.9 | -174.5 | 0 | 0 | 0 | 0 | 111.1 | I155 H161 P162 G163 M168 R169 | I155-C166 HydrophobicContact CB-CB 4.08Å; I155-C166 HydrophobicContact CD1-CB 4.1Å; I155-C166 HydrophobicContact CG1-CB 4.48Å; I155-C166 HydrophobicContact CG2-CB 4.42Å; H161-C166 VanDerWaalsContact CD2-CA 3.45Å; H161-C166 WeakPolarHBondContact CD2-CA 2.94Å; H161-C166 WeakPolarHBondContact NE2-CA 3.37Å; P162-C166 PolarHBondContact O-N 2.96Å; G163-C166 VanDerWaalsContact O-CB 3.26Å; G163-C166 WeakPolarHBondContact O-CB 3.29Å; G163-C166 PolarHBondContact O-N 3.43Å; C166-M168 PolarHBondContact O-N 3.28Å; C166-M168 PolarHBondContact SG-N 3.37Å; C166-R169 HydrophobicContact CB-CB 4.29Å; C166-R169 WeakPolarHBondContact O-CB 3.39Å; C166-R169 PolarHBondContact O-N 3.08Å | ||
| 167 | E | 86.4 | Confident | 85.9 | Confident | 171 Ų | 171 | 59.8 Ų | 59.8 | 80% | 0.799 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | -28.4 | 172.9 | -63.8 | 178 | 176.7 | 0 | 0 | 112 | L165 R169 | L165-E167 PolarHBondContact O-N 3.42Å; E167-R169 PolarHBondContact O-N 3.22Å |
| 168 | M | 88.7 | Confident | 85.7 | Confident | 64 Ų | 64 | 61.6 Ų | 61.6 | 32% | 0.315 | 33% | 0.33 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.9 | 14.1 | 171.8 | -48.3 | -150.1 | -56.3 | 0 | 0 | 113 | P38 I155 C156 C166 F177 | P38-M168 HydrophobicContact CG-SD 4.29Å; I155-M168 HydrophobicContact CG2-CB 4.31Å; I155-M168 WeakPolarHBondContact CG2-O 3.27Å; C156-M168 VanDerWaalsContact CA-CE 3.41Å; C156-M168 HydrophobicContact CB-CB 4.45Å; C156-M168 HydrophobicContact CB-CE 3.14Å; C156-M168 HydrophobicContact CB-CG 4.2Å; C156-M168 HydrophobicContact CB-SD 4.28Å; C166-M168 PolarHBondContact O-N 3.28Å; C166-M168 PolarHBondContact SG-N 3.37Å; M168-F177 WeakPolarHBondContact O-CD1 3.48Å; M168-F177 WeakPolarHBondContact O-CE1 3.41Å |
| 169 | R | 89.8 | Confident | 85.8 | Confident | 72 Ų | 72 | 59.9 Ų | 59.9 | 27% | 0.272 | 32% | 0.317 | S | S | . | . | P | Polyproline II helix | trans | -74.9 | 130.6 | 172.5 | -178.8 | 176.8 | 177.5 | 146.9 | 12.3 | 109.7 | I155 Y164 C166 E167 | I155-R169 HydrophobicContact CD1-CB 3.83Å; I155-R169 HydrophobicContact CD1-CG 3.89Å; Y164-R169 VanDerWaalsContact CA-NH1 3.28Å; Y164-R169 VanDerWaalsContact CB-NH1 3.33Å; C166-R169 HydrophobicContact CB-CB 4.29Å; C166-R169 WeakPolarHBondContact O-CB 3.39Å; C166-R169 PolarHBondContact O-N 3.08Å; E167-R169 PolarHBondContact O-N 3.22Å |
| 170 | A | 88.6 | Confident | 85.9 | Confident | 33 Ų | 33 | 56.4 Ų | 56.4 | 27% | 0.273 | 31% | 0.306 | S | S | . | . | P | Polyproline II helix | trans | -69.6 | 139.9 | 171.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | L172 F177 | A170-L172 PolarHBondContact O-N 3.13Å; A170-F177 HydrophobicContact CB-CD1 4.15Å; A170-F177 HydrophobicContact CB-CE1 3.82Å; A170-F177 HydrophobicContact CB-CZ 4.32Å |
| 171 | C | 87 | Confident | 86.1 | Confident | 1 Ų | 1 | 55.3 Ų | 55.3 | 1% | 0.007 | 29% | 0.289 | C | S | . | . | P | Polyproline II helix | trans | -60.3 | 132.2 | 172.9 | 174.8 | 0 | 0 | 0 | 0 | 110.8 | I173 C174 F175 T176 H179 | C171-I173 PolarHBondContact O-N 3.11Å; C171-I173 PolarHBondContact SG-N 3.3Å; C171-I173 VanDerWaalsContact SG-N 3.4Å; C171-C174 HydrophobicContact CB-CB 4.27Å; C171-F175 WeakPolarHBondContact O-CA 3.32Å; C171-F175 PolarHBondContact O-N 3.42Å; C171-T176 WeakPolarHBondContact CB-O 3.39Å; C171-T176 PolarHBondContact N-O 2.76Å; C171-H179 VanDerWaalsContact CB-NE2 3.29Å; C171-H179 WeakPolarHBondContact CB-NE2 3.38Å; C171-H179 PolarHBondContact SG-NE2 3.38Å |
| 172 | L | 83.5 | Confident | 86.3 | Confident | 85 Ų | 85 | 58.5 Ų | 58.5 | 45% | 0.445 | 32% | 0.316 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78 | -4.9 | -178.9 | -56.2 | -178.7 | 0 | 0 | 0 | 114 | A170 S181 | A170-L172 PolarHBondContact O-N 3.13Å; L172-S181 WeakPolarHBondContact CB-OG 3.3Å; L172-S181 PolarHBondContact N-OG 3.4Å; L172-S181 VanDerWaalsContact N-OG 3.07Å |
| 173 | I | 84 | Confident | 86.5 | Confident | 18 Ų | 18 | 65.2 Ų | 65.2 | 9% | 0.092 | 34% | 0.343 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.5 | -40.7 | 176.4 | -64.6 | 168.8 | 0 | 0 | 0 | 110.2 | C171 S181 C184 R188 I191 | C171-I173 PolarHBondContact O-N 3.11Å; C171-I173 PolarHBondContact SG-N 3.3Å; C171-I173 VanDerWaalsContact SG-N 3.4Å; I173-S181 WeakPolarHBondContact CD1-O 3.46Å; I173-C184 HydrophobicContact CB-CB 4.38Å; I173-C184 HydrophobicContact CD1-CB 3.84Å; I173-R188 HydrophobicContact CD1-CB 4.17Å; I173-R188 HydrophobicContact CG1-CB 4.34Å; I173-R188 HydrophobicContact CG1-CG 4.41Å; I173-R188 HydrophobicContact CG2-CB 4.34Å; I173-I191 HydrophobicContact CG2-CG1 4.32Å; I173-I191 WeakPolarHBondContact O-CG2 3.13Å |
| 174 | C | 84.9 | Confident | 86.7 | Confident | 6 Ų | 6 | 66.3 Ų | 66.3 | 4% | 0.041 | 35% | 0.35 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -125.3 | -13.3 | -156.8 | 110.1 | 0 | 0 | 0 | 0 | 111.3 | C171 T176 H179 C184 M186 | C171-C174 HydrophobicContact CB-CB 4.27Å; C174-T176 PolarHBondContact O-N 3.31Å; C174-T176 VanDerWaalsContact O-N 3.09Å; C174-T176 PolarHBondContact SG-N 3.42Å; C174-T176 VanDerWaalsContact SG-N 3.44Å; C174-T176 PolarHBondContact SG-OG1 2.96Å; C174-H179 PolarHBondContact SG-CE1 2.96Å; C174-H179 PolarHBondContact SG-NE2 3.42Å; C174-C184 VanDerWaalsContact CB-SG 3.55Å; C174-M186 HydrophobicContact CB-CE 3.36Å |
| 175 | F | 83.7 | Confident | 87 | Confident | 78 Ų | 78 | 67.7 Ų | 67.7 | 34% | 0.342 | 37% | 0.37 | S | S | . | . | trans | 61.6 | 7.1 | 178.1 | -54.1 | -73.7 | 0 | 0 | 0 | 116 | C171 F264 F266 | C171-F175 WeakPolarHBondContact O-CA 3.32Å; C171-F175 PolarHBondContact O-N 3.42Å; F175-F264 HydrophobicContact CE2-CD2 4.21Å; F175-F264 HydrophobicContact CZ-CD2 4.32Å; F175-F266 HydrophobicContact CE2-CZ 4.39Å | ||
| 176 | T | 85.2 | Confident | 87 | Confident | 57 Ų | 57 | 67 Ų | 67 | 35% | 0.35 | 37% | 0.366 | S | S | . | . | trans | -90.5 | 158.3 | 171.3 | 76.5 | 0 | 0 | 0 | 0 | 112.3 | C171 C174 H179 | C171-T176 WeakPolarHBondContact CB-O 3.39Å; C171-T176 PolarHBondContact N-O 2.76Å; C174-T176 PolarHBondContact O-N 3.31Å; C174-T176 VanDerWaalsContact O-N 3.09Å; C174-T176 PolarHBondContact SG-N 3.42Å; C174-T176 VanDerWaalsContact SG-N 3.44Å; C174-T176 PolarHBondContact SG-OG1 2.96Å; T176-H179 PolarHBondContact OG1-CE1 3.29Å; T176-H179 VanDerWaalsContact OG1-CE1 3.29Å | ||
| 177 | F | 88.6 | Confident | 86.9 | Confident | 122 Ų | 122 | 69.3 Ų | 69.3 | 54% | 0.535 | 38% | 0.381 | S | S | . | . | S | Bend | trans | -86.2 | 169.4 | 178.3 | -59.6 | -76.3 | 0 | 0 | 0 | 112 | M168 A170 | M168-F177 WeakPolarHBondContact O-CD1 3.48Å; M168-F177 WeakPolarHBondContact O-CE1 3.41Å; A170-F177 HydrophobicContact CB-CD1 4.15Å; A170-F177 HydrophobicContact CB-CE1 3.82Å; A170-F177 HydrophobicContact CB-CZ 4.32Å |
| 178 | G | 86.4 | Confident | 86.7 | Confident | 70 Ų | 70 | 65.2 Ų | 65.2 | 72% | 0.722 | 36% | 0.359 | S | S | * | . | S | Bend | trans | 93.6 | -2.6 | 172.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 179 | H | 89.5 | Confident | 86.4 | Confident | 38 Ų | 38 | 65.8 Ų | 65.8 | 18% | 0.176 | 37% | 0.369 | C | S | . | . | S | Bend | trans | -150.7 | 152.8 | 173.1 | 63.8 | -83.8 | 0 | 0 | 0 | 112.7 | C171 C174 T176 C184 | C171-H179 VanDerWaalsContact CB-NE2 3.29Å; C171-H179 WeakPolarHBondContact CB-NE2 3.38Å; C171-H179 PolarHBondContact SG-NE2 3.38Å; C174-H179 PolarHBondContact SG-CE1 2.96Å; C174-H179 PolarHBondContact SG-NE2 3.42Å; T176-H179 PolarHBondContact OG1-CE1 3.29Å; T176-H179 VanDerWaalsContact OG1-CE1 3.29Å; H179-C184 VanDerWaalsContact CD2-CA 3.41Å; H179-C184 WeakPolarHBondContact CD2-CA 3.42Å |
| 180 | F | 87.4 | Confident | 86.1 | Confident | 91 Ų | 91 | 66.9 Ų | 66.9 | 40% | 0.399 | 38% | 0.38 | S | S | . | . | trans | -77.7 | 154.1 | 169.4 | -61.6 | -76.8 | 0 | 0 | 0 | 110.7 | S182 K183 C184 | F180-S182 PolarHBondContact O-N 2.93Å; F180-K183 CarbonylContact O-C 3.48Å; F180-K183 WeakPolarHBondContact O-CA 3.48Å; F180-K183 PolarHBondContact O-N 3.11Å; F180-C184 PolarHBondContact O-N 3.21Å | ||
| 181 | S | 87 | Confident | 85.9 | Confident | 40 Ų | 40 | 65.5 Ų | 65.5 | 28% | 0.28 | 37% | 0.368 | S | S | . | . | G | 310 helix | trans | -53.1 | -29 | 176.7 | -51.7 | 0 | 0 | 0 | 0 | 113.6 | L172 I173 K183 C184 | L172-S181 WeakPolarHBondContact CB-OG 3.3Å; L172-S181 PolarHBondContact N-OG 3.4Å; L172-S181 VanDerWaalsContact N-OG 3.07Å; I173-S181 WeakPolarHBondContact CD1-O 3.46Å; S181-K183 VanDerWaalsContact C-N 3.27Å; S181-K183 PolarHBondContact O-N 3.3Å; S181-C184 WeakPolarHBondContact O-CB 3.38Å; S181-C184 PolarHBondContact O-N 3.06Å |
| 182 | S | 86.3 | Confident | 85.7 | Confident | 109 Ų | 109 | 67.9 Ų | 67.9 | 76% | 0.762 | 38% | 0.377 | S | S | * | . | G | 310 helix | trans | -68.7 | -21.5 | 175.9 | 53.3 | 0 | 0 | 0 | 0 | 114.3 | F180 | F180-S182 PolarHBondContact O-N 2.93Š|
| 183 | K | 89.2 | Confident | 85.8 | Confident | 160 Ų | 160 | 71.7 Ų | 71.7 | 70% | 0.696 | 39% | 0.39 | S | S | * | . | G | 310 helix | trans | -114.7 | 21.9 | 178.4 | -61.4 | -173.5 | 178.1 | -176.5 | 0 | 111.7 | F180 S181 | F180-K183 CarbonylContact O-C 3.48Å; F180-K183 WeakPolarHBondContact O-CA 3.48Å; F180-K183 PolarHBondContact O-N 3.11Å; S181-K183 VanDerWaalsContact C-N 3.27Å; S181-K183 PolarHBondContact O-N 3.3Å |
| 184 | C | 89.7 | Confident | 85.9 | Confident | 22 Ų | 22 | 78 Ų | 78 | 15% | 0.149 | 41% | 0.413 | C | S | . | . | trans | -67.5 | 124.3 | 179.3 | -179.6 | 0 | 0 | 0 | 0 | 110.3 | I173 C174 H179 F180 S181 M186 | I173-C184 HydrophobicContact CB-CB 4.38Å; I173-C184 HydrophobicContact CD1-CB 3.84Å; C174-C184 VanDerWaalsContact CB-SG 3.55Å; H179-C184 VanDerWaalsContact CD2-CA 3.41Å; H179-C184 WeakPolarHBondContact CD2-CA 3.42Å; F180-C184 PolarHBondContact O-N 3.21Å; S181-C184 WeakPolarHBondContact O-CB 3.38Å; S181-C184 PolarHBondContact O-N 3.06Å; C184-M186 PolarHBondContact O-N 3.11Å; C184-M186 PolarHBondContact SG-N 3.3Å; C184-M186 VanDerWaalsContact SG-N 3.42Å; C184-M186 PolarHBondContact SG-O 2.92Å | ||
| 185 | P | 89.1 | Confident | 86.2 | Confident | 114 Ų | 114 | 82.1 Ų | 82.1 | 74% | 0.74 | 43% | 0.434 | S | S | * | . | S | Bend | trans | -67.3 | -22.6 | 177.6 | 28 | -34.5 | 0 | 0 | 0 | 111.9 | ||
| 186 | M | 85.3 | Confident | 86.6 | Confident | 54 Ų | 54 | 78.6 Ų | 78.6 | 27% | 0.266 | 42% | 0.419 | S | S | . | . | S | Bend | trans | -88.1 | 129.3 | 175.6 | -58.5 | -158.3 | -81.9 | 0 | 0 | 110.7 | C174 C184 R188 I191 L205 | C174-M186 HydrophobicContact CB-CE 3.36Å; C184-M186 PolarHBondContact O-N 3.11Å; C184-M186 PolarHBondContact SG-N 3.3Å; C184-M186 VanDerWaalsContact SG-N 3.42Å; C184-M186 PolarHBondContact SG-O 2.92Å; M186-R188 PolarHBondContact O-N 2.82Å; M186-I191 HydrophobicContact CB-CG1 4.14Å; M186-I191 HydrophobicContact CE-CD1 4.03Å; M186-I191 HydrophobicContact SD-CD1 3.79Å; M186-I191 HydrophobicContact SD-CG1 4.4Å; M186-L205 HydrophobicContact CE-CD1 3.93Å; M186-L205 HydrophobicContact CE-CG 4.42Å; M186-L205 HydrophobicContact SD-CD1 4.12Å; M186-L205 HydrophobicContact SD-CD2 4.45Å |
| 187 | S | 83.7 | Confident | 86.9 | Confident | 50 Ų | 50 | 81.4 Ų | 81.4 | 35% | 0.35 | 43% | 0.432 | S | S | . | . | trans | -67.3 | 136.2 | 173.3 | 88.6 | 0 | 0 | 0 | 0 | 110 | S189 N190 I191 | S187-S189 VanDerWaalsContact C-N 3.25Å; S187-S189 PolarHBondContact O-N 3.27Å; S187-N190 PolarHBondContact O-N 3.07Å; S187-N190 VanDerWaalsContact O-N 3.1Å; S187-N190 VanDerWaalsContact OG-CB 3.23Å; S187-N190 WeakPolarHBondContact OG-CB 3.25Å; S187-N190 PolarHBondContact OG-N 3.39Å; S187-N190 PolarHBondContact OG-ND2 3.4Å; S187-I191 PolarHBondContact O-N 2.95Å | ||
| 188 | R | 82.4 | Confident | 87 | Confident | 85 Ų | 85 | 77.3 Ų | 77.3 | 32% | 0.321 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -54.3 | -46.7 | 175.2 | -173.5 | 171.3 | 162.9 | 78.3 | 12.5 | 110.2 | I173 M186 N190 I191 Y192 N261 R262 | I173-R188 HydrophobicContact CD1-CB 4.17Å; I173-R188 HydrophobicContact CG1-CB 4.34Å; I173-R188 HydrophobicContact CG1-CG 4.41Å; I173-R188 HydrophobicContact CG2-CB 4.34Å; M186-R188 PolarHBondContact O-N 2.82Å; R188-N190 VanDerWaalsContact C-N 3.27Å; R188-N190 PolarHBondContact O-N 3.17Å; R188-I191 PolarHBondContact O-N 3.21Å; R188-Y192 HydrophobicContact CG-CD2 3.49Å; R188-Y192 VanDerWaalsContact CG-CD2 3.49Å; R188-Y192 HydrophobicContact CG-CE2 3.45Å; R188-Y192 VanDerWaalsContact CG-CE2 3.45Å; R188-Y192 HydrophobicContact CG-CG 4.44Å; R188-Y192 VanDerWaalsContact NH1-CE2 3.32Å; R188-Y192 VanDerWaalsContact NH1-CZ 3.3Å; R188-Y192 PolarHBondContact NH1-OH 2.95Å; R188-Y192 PolarHBondContact NH2-OH 2.96Å; R188-Y192 WeakPolarHBondContact O-CB 3.28Å; R188-Y192 WeakPolarHBondContact O-CD2 3.48Å; R188-Y192 PolarHBondContact O-N 3.41Å; R188-N261 PolarHBondContact NH2-O 3.08Å; R188-N261 VanDerWaalsContact NH2-O 3.1Å; R188-R262 PolarHBondContact NH1-O 3.34Å |
| 189 | S | 83 | Confident | 87.2 | Confident | 76 Ų | 76 | 74 Ų | 74 | 53% | 0.531 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -56.3 | -37.4 | 177.9 | -55.5 | 0 | 0 | 0 | 0 | 113.8 | S187 K193 | S187-S189 VanDerWaalsContact C-N 3.25Å; S187-S189 PolarHBondContact O-N 3.27Å; S189-K193 WeakPolarHBondContact O-CG 3.45Å; S189-K193 PolarHBondContact O-N 3.02Å |
| 190 | N | 84.3 | Confident | 87.2 | Confident | 96 Ų | 96 | 78.1 Ų | 78.1 | 51% | 0.513 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -67.6 | -48.9 | 178.4 | -76.4 | -18.9 | 0 | 0 | 0 | 111.5 | S187 R188 Y192 K193 R194 | S187-N190 PolarHBondContact O-N 3.07Å; S187-N190 VanDerWaalsContact O-N 3.1Å; S187-N190 VanDerWaalsContact OG-CB 3.23Å; S187-N190 WeakPolarHBondContact OG-CB 3.25Å; S187-N190 PolarHBondContact OG-N 3.39Å; S187-N190 PolarHBondContact OG-ND2 3.4Å; R188-N190 VanDerWaalsContact C-N 3.27Å; R188-N190 PolarHBondContact O-N 3.17Å; N190-Y192 VanDerWaalsContact C-N 3.3Å; N190-Y192 PolarHBondContact O-N 3.47Å; N190-K193 PolarHBondContact O-N 3.33Å; N190-R194 WeakPolarHBondContact O-CG 3.32Å; N190-R194 PolarHBondContact O-N 3.42Å |
| 191 | I | 84.5 | Confident | 87.3 | Confident | 4 Ų | 4 | 74.6 Ų | 74.6 | 2% | 0.021 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -64 | -38.2 | 178.5 | -65.3 | -63.1 | 0 | 0 | 0 | 111.2 | I173 M186 S187 R188 K193 R194 G203 L205 F264 | I173-I191 HydrophobicContact CG2-CG1 4.32Å; I173-I191 WeakPolarHBondContact O-CG2 3.13Å; M186-I191 HydrophobicContact CB-CG1 4.14Å; M186-I191 HydrophobicContact CE-CD1 4.03Å; M186-I191 HydrophobicContact SD-CD1 3.79Å; M186-I191 HydrophobicContact SD-CG1 4.4Å; S187-I191 PolarHBondContact O-N 2.95Å; R188-I191 PolarHBondContact O-N 3.21Å; I191-K193 VanDerWaalsContact C-N 3.31Å; I191-K193 PolarHBondContact O-N 2.82Å; I191-R194 PolarHBondContact O-N 3.1Å; I191-G203 WeakPolarHBondContact CG2-O 3.31Å; I191-G203 VanDerWaalsContact O-CA 3.3Å; I191-G203 WeakPolarHBondContact O-CA 3.25Å; I191-G203 PolarHBondContact O-N 3.34Å; I191-L205 HydrophobicContact CD1-CD2 3.87Å; I191-L205 HydrophobicContact CD1-CG 4.33Å; I191-F264 HydrophobicContact CG2-CE2 3.84Å; I191-F264 HydrophobicContact CG2-CZ 3.92Å |
| 192 | Y | 81.4 | Confident | 87.3 | Confident | 50 Ų | 50 | 79.8 Ų | 79.8 | 20% | 0.196 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -65.2 | -30.8 | -179.1 | -87.7 | -108.3 | 0 | 0 | 0 | 114.3 | R188 N190 N261 R262 F264 | R188-Y192 HydrophobicContact CG-CD2 3.49Å; R188-Y192 VanDerWaalsContact CG-CD2 3.49Å; R188-Y192 HydrophobicContact CG-CE2 3.45Å; R188-Y192 VanDerWaalsContact CG-CE2 3.45Å; R188-Y192 HydrophobicContact CG-CG 4.44Å; R188-Y192 VanDerWaalsContact NH1-CE2 3.32Å; R188-Y192 VanDerWaalsContact NH1-CZ 3.3Å; R188-Y192 PolarHBondContact NH1-OH 2.95Å; R188-Y192 PolarHBondContact NH2-OH 2.96Å; R188-Y192 WeakPolarHBondContact O-CB 3.28Å; R188-Y192 WeakPolarHBondContact O-CD2 3.48Å; R188-Y192 PolarHBondContact O-N 3.41Å; N190-Y192 VanDerWaalsContact C-N 3.3Å; N190-Y192 PolarHBondContact O-N 3.47Å; Y192-N261 VanDerWaalsContact CE1-O 3.25Å; Y192-N261 WeakPolarHBondContact CE1-O 3.42Å; Y192-N261 PolarHBondContact OH-O 2.81Å; Y192-N261 VanDerWaalsContact OH-O 3.1Å; Y192-R262 PolarHBondContact OH-O 2.82Å; Y192-F264 HydrophobicContact CD1-CD1 4.47Å; Y192-F264 AromaticContact CD1-CE1 3.45Å; Y192-F264 HydrophobicContact CD1-CE1 3.45Å; Y192-F264 VanDerWaalsContact CD1-CE1 3.45Å; Y192-F264 AromaticContact CD1-CZ 3.75Å; Y192-F264 HydrophobicContact CD1-CZ 3.75Å; Y192-F264 AromaticContact CD2-CE1 3.72Å; Y192-F264 HydrophobicContact CD2-CE1 3.72Å; Y192-F264 AromaticContact CD2-CE2 3.94Å; Y192-F264 HydrophobicContact CD2-CE2 3.94Å; Y192-F264 AromaticContact CD2-CZ 3.07Å; Y192-F264 HydrophobicContact CD2-CZ 3.07Å; Y192-F264 HydrophobicContact CE1-CD1 4.21Å; Y192-F264 AromaticContact CE1-CE1 3.49Å; Y192-F264 HydrophobicContact CE1-CE1 3.49Å; Y192-F264 VanDerWaalsContact CE1-CE1 3.49Å; Y192-F264 AromaticContact CE1-CZ 3.73Å; Y192-F264 HydrophobicContact CE1-CZ 3.73Å; Y192-F264 AromaticContact CE2-CE1 3.75Å; Y192-F264 HydrophobicContact CE2-CE1 3.75Å; Y192-F264 AromaticContact CE2-CE2 3.49Å; Y192-F264 HydrophobicContact CE2-CE2 3.49Å; Y192-F264 VanDerWaalsContact CE2-CE2 3.49Å; Y192-F264 AromaticContact CE2-CZ 3.03Å; Y192-F264 HydrophobicContact CE2-CZ 3.03Å; Y192-F264 AromaticContact CG-CE1 3.53Å; Y192-F264 HydrophobicContact CG-CE1 3.53Å; Y192-F264 AromaticContact CG-CZ 3.41Å; Y192-F264 HydrophobicContact CG-CZ 3.41Å; Y192-F264 VanDerWaalsContact CG-CZ 3.41Å; Y192-F264 AromaticContact CZ-CE1 3.57Å; Y192-F264 AromaticContact CZ-CE2 3.78Å; Y192-F264 AromaticContact CZ-CZ 3.32Å |
| 193 | K | 85.4 | Confident | 87.2 | Confident | 165 Ų | 165 | 74.6 Ų | 74.6 | 72% | 0.717 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -85.7 | -23 | 179.2 | -70.3 | 176.4 | -178.4 | -176.4 | 0 | 113.1 | S189 N190 I191 I195 | S189-K193 WeakPolarHBondContact O-CG 3.45Å; S189-K193 PolarHBondContact O-N 3.02Å; N190-K193 PolarHBondContact O-N 3.33Å; I191-K193 VanDerWaalsContact C-N 3.31Å; I191-K193 PolarHBondContact O-N 2.82Å; K193-I195 PolarHBondContact O-N 3.07Å |
| 194 | R | 87.5 | Confident | 87.1 | Confident | 151 Ų | 151 | 67.3 Ų | 67.3 | 57% | 0.57 | 33% | 0.33 | S | S | * | . | trans | -69.4 | 130.9 | -179.7 | -75.6 | -170 | -172.4 | -86.6 | 2.4 | 110.8 | N190 I191 R202 G203 | N190-R194 WeakPolarHBondContact O-CG 3.32Å; N190-R194 PolarHBondContact O-N 3.42Å; I191-R194 PolarHBondContact O-N 3.1Å; R194-R202 WeakPolarHBondContact O-CA 3.48Å; R194-R202 WeakPolarHBondContact O-CB 3.17Å; R194-G203 PolarHBondContact O-N 3.48Å | ||
| 195 | I | 90.4 | Very high | 86.9 | Confident | 93 Ų | 93 | 68.4 Ų | 68.4 | 48% | 0.477 | 33% | 0.334 | S | S | . | . | B | Isolated β-bridge | trans | -104.6 | 131.3 | 172.7 | -61.4 | 169.3 | 0 | 0 | 0 | 106.8 | K193 R202 | K193-I195 PolarHBondContact O-N 3.07Å; I195-R202 HydrophobicContact CG1-CG 3.79Å |
| 196 | C | 91.7 | Very high | 86.7 | Confident | 4 Ų | 4 | 67.8 Ų | 67.8 | 3% | 0.027 | 32% | 0.321 | C | S | . | . | trans | -74.4 | 134.3 | 176.7 | 177.8 | 0 | 0 | 0 | 0 | 111.3 | R198 H200 C201 H204 C209 | C196-R198 VanDerWaalsContact C-N 3.29Å; C196-R198 PolarHBondContact O-N 3.47Å; C196-R198 PolarHBondContact SG-N 3.17Å; C196-R198 VanDerWaalsContact SG-N 3.35Å; C196-H200 WeakPolarHBondContact O-CA 3.32Å; C196-H200 PolarHBondContact O-N 3.38Å; C196-C201 WeakPolarHBondContact CB-O 3.28Å; C196-C201 PolarHBondContact N-O 3.26Å; C196-H204 WeakPolarHBondContact CB-NE2 3.29Å; C196-H204 PolarHBondContact SG-NE2 3.09Å; C196-H204 VanDerWaalsContact SG-NE2 3.39Å; C196-C209 PolarHBondContact SG-SG 3.36Å | ||
| 197 | N | 91.4 | Very high | 86.7 | Confident | 116 Ų | 116 | 70.5 Ų | 70.5 | 62% | 0.62 | 33% | 0.331 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.7 | -26.2 | 177.6 | -62.7 | -34.6 | 0 | 0 | 0 | 112.9 | H200 E206 | N197-H200 PolarHBondContact O-CE1 3.14Å; N197-E206 PolarHBondContact ND2-OE2 3.16Å |
| 198 | R | 90.8 | Very high | 86.8 | Confident | 36 Ų | 36 | 70.9 Ų | 70.9 | 14% | 0.136 | 33% | 0.329 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -81.2 | -52.1 | -179 | -173.5 | -177.1 | -172.1 | 84.6 | 9.3 | 113.6 | C196 D211 V272 S274 | C196-R198 VanDerWaalsContact C-N 3.29Å; C196-R198 PolarHBondContact O-N 3.47Å; C196-R198 PolarHBondContact SG-N 3.17Å; C196-R198 VanDerWaalsContact SG-N 3.35Å; R198-D211 HydrophobicContact CG-CB 4.46Å; R198-V272 PolarHBondContact NH2-O 2.96Å; R198-V272 VanDerWaalsContact NH2-O 3.15Å; R198-S274 PolarHBondContact NH1-OG 3.28Å; R198-S274 PolarHBondContact NH2-OG 3.49Å |
| 199 | C | 91.4 | Very high | 87.2 | Confident | 0 Ų | 0 | 66.8 Ų | 66.8 | 0% | 0 | 31% | 0.314 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -107.9 | -9.9 | -172.9 | 74.8 | 0 | 0 | 0 | 0 | 114 | C201 H204 D211 K267 | C199-C201 PolarHBondContact O-N 3.4Å; C199-C201 VanDerWaalsContact O-N 3.11Å; C199-C201 PolarHBondContact SG-N 3.1Å; C199-C201 VanDerWaalsContact SG-N 3.4Å; C199-H204 PolarHBondContact SG-CE1 3.13Å; C199-H204 PolarHBondContact SG-NE2 2.75Å; C199-H204 VanDerWaalsContact SG-NE2 3.37Å; C199-D211 HydrophobicContact CB-CB 4.26Å; C199-D211 WeakPolarHBondContact CB-OD2 3.22Å; C199-K267 PolarHBondContact O-NZ 3.29Å |
| 200 | H | 90.4 | Very high | 87.5 | Confident | 125 Ų | 125 | 64.4 Ų | 64.4 | 58% | 0.579 | 30% | 0.296 | S | S | * | . | trans | 60.4 | 11.7 | -175.7 | -49.4 | -57.7 | 0 | 0 | 0 | 115.3 | C196 N197 | C196-H200 WeakPolarHBondContact O-CA 3.32Å; C196-H200 PolarHBondContact O-N 3.38Å; N197-H200 PolarHBondContact O-CE1 3.14Å | ||
| 201 | C | 88.2 | Confident | 87.7 | Confident | 17 Ų | 17 | 59.8 Ų | 59.8 | 12% | 0.115 | 27% | 0.272 | C | S | . | . | trans | -83.3 | 153.5 | 168.2 | -64.6 | 0 | 0 | 0 | 0 | 110.7 | C196 C199 H204 | C196-C201 WeakPolarHBondContact CB-O 3.28Å; C196-C201 PolarHBondContact N-O 3.26Å; C199-C201 PolarHBondContact O-N 3.4Å; C199-C201 VanDerWaalsContact O-N 3.11Å; C199-C201 PolarHBondContact SG-N 3.1Å; C199-C201 VanDerWaalsContact SG-N 3.4Å; C201-H204 PolarHBondContact O-CE1 3.29Å | ||
| 202 | R | 87.4 | Confident | 87.8 | Confident | 149 Ų | 149 | 61 Ų | 61 | 56% | 0.562 | 28% | 0.279 | S | S | * | . | B | Isolated β-bridge | trans | -84 | 163.4 | 174.6 | -68.6 | 175.8 | -179.2 | 167.3 | 1.1 | 111.7 | R194 I195 H204 F264 | R194-R202 WeakPolarHBondContact O-CA 3.48Å; R194-R202 WeakPolarHBondContact O-CB 3.17Å; I195-R202 HydrophobicContact CG1-CG 3.79Å; R202-H204 PolarHBondContact O-ND1 3.25Å; R202-F264 HydrophobicContact CB-CD1 4.46Å |
| 203 | G | 84.3 | Confident | 88 | Confident | 0 Ų | 0 | 67 Ų | 67 | 0% | 0 | 30% | 0.302 | C | S | . | . | S | Bend | trans | 93.9 | 20.3 | 156.8 | 0 | 0 | 0 | 0 | 0 | 118.3 | I191 R194 F264 | I191-G203 WeakPolarHBondContact CG2-O 3.31Å; I191-G203 VanDerWaalsContact O-CA 3.3Å; I191-G203 WeakPolarHBondContact O-CA 3.25Å; I191-G203 PolarHBondContact O-N 3.34Å; R194-G203 PolarHBondContact O-N 3.48Å; G203-F264 VanDerWaalsContact CA-CD2 3.44Å; G203-F264 WeakPolarHBondContact O-CD2 3.21Å; G203-F264 WeakPolarHBondContact O-CE2 3.33Å |
| 204 | H | 86.9 | Confident | 88 | Confident | 7 Ų | 7 | 62.5 Ų | 62.5 | 3% | 0.032 | 28% | 0.28 | C | S | . | . | S | Bend | trans | -150.7 | 162.2 | 174.7 | 55.5 | -76.9 | 0 | 0 | 0 | 109.1 | C196 C199 C201 R202 C209 F266 | C196-H204 WeakPolarHBondContact CB-NE2 3.29Å; C196-H204 PolarHBondContact SG-NE2 3.09Å; C196-H204 VanDerWaalsContact SG-NE2 3.39Å; C199-H204 PolarHBondContact SG-CE1 3.13Å; C199-H204 PolarHBondContact SG-NE2 2.75Å; C199-H204 VanDerWaalsContact SG-NE2 3.37Å; C201-H204 PolarHBondContact O-CE1 3.29Å; R202-H204 PolarHBondContact O-ND1 3.25Å; H204-C209 VanDerWaalsContact CD2-CA 3.41Å; H204-C209 WeakPolarHBondContact CD2-CA 3.2Å; H204-C209 PolarHBondContact NE2-SG 3.14Å; H204-F266 HydrophobicContact CB-CE1 4.39Å; H204-F266 AromaticContact ND1-CE1 3.56Å |
| 205 | L | 85.2 | Confident | 88 | Confident | 44 Ų | 44 | 55.3 Ų | 55.3 | 23% | 0.23 | 25% | 0.253 | C | S | . | . | trans | -79.9 | 156.2 | 169.1 | -57.8 | 176.7 | 0 | 0 | 0 | 109.4 | M186 I191 K207 D208 C209 | M186-L205 HydrophobicContact CE-CD1 3.93Å; M186-L205 HydrophobicContact CE-CG 4.42Å; M186-L205 HydrophobicContact SD-CD1 4.12Å; M186-L205 HydrophobicContact SD-CD2 4.45Å; I191-L205 HydrophobicContact CD1-CD2 3.87Å; I191-L205 HydrophobicContact CD1-CG 4.33Å; L205-K207 VanDerWaalsContact C-N 3.26Å; L205-K207 HydrophobicContact CB-CG 4.05Å; L205-K207 PolarHBondContact O-N 3.27Å; L205-D208 WeakPolarHBondContact CB-OD2 3.41Å; L205-D208 CarbonylContact O-C 3.43Å; L205-D208 WeakPolarHBondContact O-CA 3.36Å; L205-D208 PolarHBondContact O-N 3.44Å; L205-C209 PolarHBondContact O-N 3.1Å | ||
| 206 | E | 85.7 | Confident | 87.6 | Confident | 101 Ų | 101 | 53.2 Ų | 53.2 | 47% | 0.472 | 24% | 0.241 | S | C | . | . | G | 310 helix | trans | -58.7 | -38.4 | -178.6 | -175.1 | 157.8 | -161.6 | 0 | 0 | 112.9 | N197 D208 C209 | N197-E206 PolarHBondContact ND2-OE2 3.16Å; E206-D208 PolarHBondContact O-N 2.89Å; E206-C209 WeakPolarHBondContact O-CB 3.41Å; E206-C209 PolarHBondContact O-N 2.82Å; E206-C209 VanDerWaalsContact O-N 3.16Å |
| 207 | K | 84.9 | Confident | 86.7 | Confident | 111 Ų | 111 | 56.6 Ų | 56.6 | 48% | 0.483 | 26% | 0.256 | S | S | . | . | G | 310 helix | trans | -62.4 | -26.7 | 172.9 | 67.4 | 179.2 | -176.2 | 179.3 | 0 | 114.5 | L205 C209 Q286 | L205-K207 VanDerWaalsContact C-N 3.26Å; L205-K207 HydrophobicContact CB-CG 4.05Å; L205-K207 PolarHBondContact O-N 3.27Å; K207-C209 VanDerWaalsContact C-N 3.35Å; K207-Q286 HydrophobicContact CB-CG 4.49Å |
| 208 | D | 86.3 | Confident | 85.2 | Confident | 58 Ų | 58 | 56.8 Ų | 56.8 | 31% | 0.31 | 27% | 0.266 | S | S | . | . | G | 310 helix | trans | -100 | 15.2 | -178.9 | -55.8 | -50.4 | 0 | 0 | 0 | 111.1 | L205 E206 P210 | L205-D208 WeakPolarHBondContact CB-OD2 3.41Å; L205-D208 CarbonylContact O-C 3.43Å; L205-D208 WeakPolarHBondContact O-CA 3.36Å; L205-D208 PolarHBondContact O-N 3.44Å; E206-D208 PolarHBondContact O-N 2.89Å; D208-P210 VanDerWaalsContact O-CD 3.25Å; D208-P210 WeakPolarHBondContact O-CD 3.29Å |
| 209 | C | 90.1 | Very high | 83.5 | Confident | 0 Ų | 0 | 57.8 Ų | 57.8 | 0% | 0 | 28% | 0.279 | C | S | . | . | trans | -63.5 | 118.1 | -179.9 | -170.7 | 0 | 0 | 0 | 0 | 110.3 | C196 H204 L205 E206 K207 D211 V212 | C196-C209 PolarHBondContact SG-SG 3.36Å; H204-C209 VanDerWaalsContact CD2-CA 3.41Å; H204-C209 WeakPolarHBondContact CD2-CA 3.2Å; H204-C209 PolarHBondContact NE2-SG 3.14Å; L205-C209 PolarHBondContact O-N 3.1Å; E206-C209 WeakPolarHBondContact O-CB 3.41Å; E206-C209 PolarHBondContact O-N 2.82Å; E206-C209 VanDerWaalsContact O-N 3.16Å; K207-C209 VanDerWaalsContact C-N 3.35Å; C209-D211 PolarHBondContact O-N 2.94Å; C209-D211 VanDerWaalsContact O-N 3.08Å; C209-V212 HydrophobicContact CB-CG2 4.19Å; C209-V212 WeakPolarHBondContact O-CB 3.49Å; C209-V212 PolarHBondContact O-N 3.49Å | ||
| 210 | P | 88.7 | Confident | 82.1 | Confident | 25 Ų | 25 | 66.2 Ų | 66.2 | 16% | 0.162 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -69.6 | -12.1 | -175.7 | 23.6 | -28.3 | 0 | 0 | 0 | 113.1 | D208 V212 W213 R214 F266 | D208-P210 VanDerWaalsContact O-CD 3.25Å; D208-P210 WeakPolarHBondContact O-CD 3.29Å; P210-V212 PolarHBondContact O-N 3.37Å; P210-W213 PolarHBondContact O-N 3.42Å; P210-R214 VanDerWaalsContact CG-NH2 3.34Å; P210-R214 VanDerWaalsContact O-CB 3.29Å; P210-R214 WeakPolarHBondContact O-CB 3.11Å; P210-R214 VanDerWaalsContact O-CG 3.28Å; P210-R214 WeakPolarHBondContact O-CG 3.34Å; P210-R214 PolarHBondContact O-N 2.83Å; P210-F266 HydrophobicContact CG-CB 4.44Å; P210-F266 HydrophobicContact CG-CD1 3.44Å; P210-F266 VanDerWaalsContact CG-CD1 3.44Å; P210-F266 HydrophobicContact CG-CE1 3.75Å; P210-F266 HydrophobicContact CG-CG 3.98Å |
| 211 | D | 88.9 | Confident | 80.6 | Confident | 0 Ų | 0 | 62.5 Ų | 62.5 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63.1 | -28.6 | 168.5 | -79.6 | 16.8 | 0 | 0 | 0 | 112.7 | R198 C199 C209 R214 Q215 T271 | R198-D211 HydrophobicContact CG-CB 4.46Å; C199-D211 HydrophobicContact CB-CB 4.26Å; C199-D211 WeakPolarHBondContact CB-OD2 3.22Å; C209-D211 PolarHBondContact O-N 2.94Å; C209-D211 VanDerWaalsContact O-N 3.08Å; D211-R214 IonicContact OD1-CZ 3.02Å; D211-R214 IonicContact OD1-NE 3.94Å; D211-R214 IonicContact OD1-NH2 3.53Å; D211-R214 PolarHBondContact OD1-NH2 3.1Å; D211-Q215 PolarHBondContact O-N 2.93Å; D211-T271 WeakPolarHBondContact OD2-CA 3.17Å; D211-T271 WeakPolarHBondContact OD2-CB 3.3Å; D211-T271 PolarHBondContact OD2-N 2.83Å; D211-T271 PolarHBondContact OD2-OG1 3.15Å |
| 212 | V | 87.9 | Confident | 79.3 | Confident | 28 Ų | 28 | 67 Ų | 67 | 17% | 0.17 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -63.9 | -40.8 | 177.1 | 175.1 | 0 | 0 | 0 | 0 | 111.4 | C209 P210 Q215 F216 L279 | C209-V212 HydrophobicContact CB-CG2 4.19Å; C209-V212 WeakPolarHBondContact O-CB 3.49Å; C209-V212 PolarHBondContact O-N 3.49Å; P210-V212 PolarHBondContact O-N 3.37Å; V212-Q215 WeakPolarHBondContact O-CG 3.15Å; V212-F216 WeakPolarHBondContact O-CD2 3.22Å; V212-F216 VanDerWaalsContact O-CE2 3.27Å; V212-F216 WeakPolarHBondContact O-CE2 3.15Å; V212-L279 HydrophobicContact CG1-CD2 4.13Å |
| 213 | W | 84.7 | Confident | 77.9 | Confident | 177 Ų | 177 | 66.6 Ų | 66.6 | 67% | 0.67 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -86.5 | -35.7 | 179.7 | -56.1 | 113.1 | 0 | 0 | 0 | 112.2 | P210 Q215 F216 | P210-W213 PolarHBondContact O-N 3.42Å; W213-Q215 PolarHBondContact O-N 3.38Å; W213-F216 HydrophobicContact CE3-CE2 4.49Å; W213-F216 PolarHBondContact O-N 3.36Å |
| 214 | R | 85.8 | Confident | 76.6 | Confident | 71 Ų | 71 | 69.3 Ų | 69.3 | 27% | 0.268 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -65.8 | -21.4 | -178.9 | -79.6 | -169.7 | -70.7 | -108.1 | 3.9 | 114.6 | P210 D211 F216 K267 V270 | P210-R214 VanDerWaalsContact CG-NH2 3.34Å; P210-R214 VanDerWaalsContact O-CB 3.29Å; P210-R214 WeakPolarHBondContact O-CB 3.11Å; P210-R214 VanDerWaalsContact O-CG 3.28Å; P210-R214 WeakPolarHBondContact O-CG 3.34Å; P210-R214 PolarHBondContact O-N 2.83Å; D211-R214 IonicContact OD1-CZ 3.02Å; D211-R214 IonicContact OD1-NE 3.94Å; D211-R214 IonicContact OD1-NH2 3.53Å; D211-R214 PolarHBondContact OD1-NH2 3.1Å; R214-F216 PolarHBondContact O-N 2.75Å; R214-K267 VanDerWaalsContact CZ-O 3.24Å; R214-K267 PolarHBondContact NH1-O 2.84Å; R214-K267 PolarHBondContact NH2-O 3.05Å; R214-V270 HydrophobicContact CB-CG2 3.61Å; R214-V270 WeakPolarHBondContact O-CG2 3.05Å |
| 215 | Q | 86 | Confident | 75.2 | Confident | 0 Ų | 0 | 76.2 Ų | 76.2 | 0% | 0 | 40% | 0.404 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.1 | -16.9 | 176.3 | 59.5 | 170.9 | 81.7 | 0 | 0 | 113.9 | D211 V212 W213 H217 L226 V270 Y273 S274 | D211-Q215 PolarHBondContact O-N 2.93Å; V212-Q215 WeakPolarHBondContact O-CG 3.15Å; W213-Q215 PolarHBondContact O-N 3.38Å; Q215-H217 PolarHBondContact O-CD2 3.26Å; Q215-H217 PolarHBondContact O-N 2.87Å; Q215-L226 HydrophobicContact CB-CD2 4.36Å; Q215-L226 HydrophobicContact CG-CD2 4.3Å; Q215-V270 HydrophobicContact CB-CG1 4.04Å; Q215-V270 HydrophobicContact CB-CG2 4.23Å; Q215-Y273 HydrophobicContact CB-CD1 3.7Å; Q215-Y273 HydrophobicContact CB-CE1 3.92Å; Q215-S274 PolarHBondContact NE2-O 2.81Å |
| 216 | F | 82.5 | Confident | 74.2 | Confident | 49 Ų | 49 | 76.4 Ų | 76.4 | 22% | 0.215 | 41% | 0.405 | C | S | . | . | B | Isolated β-bridge | trans | -83.9 | 100 | 171.6 | -61.7 | -76 | 0 | 0 | 0 | 108.8 | V212 W213 R214 C224 L276 L279 | V212-F216 WeakPolarHBondContact O-CD2 3.22Å; V212-F216 VanDerWaalsContact O-CE2 3.27Å; V212-F216 WeakPolarHBondContact O-CE2 3.15Å; W213-F216 HydrophobicContact CE3-CE2 4.49Å; W213-F216 PolarHBondContact O-N 3.36Å; R214-F216 PolarHBondContact O-N 2.75Å; F216-C224 HydrophobicContact CD1-CB 3.91Å; F216-C224 HydrophobicContact CE1-CB 4.24Å; F216-L276 HydrophobicContact CE1-CD2 4.07Å; F216-L279 HydrophobicContact CE1-CD1 4.36Å; F216-L279 HydrophobicContact CE2-CD1 3.94Å; F216-L279 HydrophobicContact CZ-CD1 3.44Å; F216-L279 VanDerWaalsContact CZ-CD1 3.44Å |
| 217 | H | 72.5 | Confident | 72.9 | Confident | 74 Ų | 74 | 72.8 Ų | 72.8 | 34% | 0.343 | 40% | 0.395 | S | S | . | . | trans | -86.1 | 129 | 176.7 | -64.7 | -71.9 | 0 | 0 | 0 | 109.6 | Q215 S219 Y273 | Q215-H217 PolarHBondContact O-CD2 3.26Å; Q215-H217 PolarHBondContact O-N 2.87Å; H217-S219 PolarHBondContact O-N 3.2Å; H217-Y273 AromaticContact CD2-CE1 3.99Å; H217-Y273 AromaticContact NE2-CE1 3.52Å; H217-Y273 AromaticContact NE2-CZ 3.6Å; H217-Y273 PolarHBondContact NE2-OH 3.37Å | ||
| 218 | S | 60 | Low | 71.7 | Confident | 120 Ų | 120 | 76.7 Ų | 76.7 | 84% | 0.839 | 42% | 0.415 | S | S | * | . | S | Bend | trans | 46.3 | 48.4 | 170.9 | -60.7 | 0 | 0 | 0 | 0 | 115.8 | I220 | S218-I220 PolarHBondContact O-N 2.79Š|
| 219 | S | 56.5 | Low | 70.1 | Confident | 58 Ų | 58 | 81.4 Ų | 81.4 | 41% | 0.406 | 44% | 0.44 | S | S | . | . | trans | -77.5 | 38 | -175.5 | 48.9 | 0 | 0 | 0 | 0 | 115.6 | H217 G221 | H217-S219 PolarHBondContact O-N 3.2Å; S219-G221 PolarHBondContact O-N 3.28Å | ||
| 220 | I | 60.5 | Low | 68.6 | Low | 176 Ų | 176 | 88.5 Ų | 88.5 | 90% | 0.903 | 47% | 0.467 | S | S | * | . | trans | -81.6 | -4.5 | 177.8 | -41.1 | 178.5 | 0 | 0 | 0 | 111.6 | S218 | S218-I220 PolarHBondContact O-N 2.79Š| ||
| 221 | G | 59 | Low | 67.1 | Low | 47 Ų | 47 | 96.1 Ų | 96.1 | 49% | 0.485 | 50% | 0.5 | S | S | . | . | S | Bend | trans | -101.6 | 164.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | S219 H223 | S219-G221 PolarHBondContact O-N 3.28Å; G221-H223 PolarHBondContact O-N 2.86Å |
| 222 | S | 61.6 | Low | 65.7 | Low | 111 Ų | 111 | 102.6 Ų | 102.6 | 78% | 0.776 | 53% | 0.529 | S | S | * | . | S | Bend | trans | -61.9 | -4.1 | 176.3 | 52.2 | 0 | 0 | 0 | 0 | 114.7 | ||
| 223 | H | 57.4 | Low | 64.4 | Low | 141 Ų | 141 | 109.3 Ų | 109.3 | 65% | 0.653 | 56% | 0.555 | S | S | * | * | trans | -126.5 | 99.2 | 179.1 | -57.7 | -70.2 | 0 | 0 | 0 | 109.1 | G221 E225 | G221-H223 PolarHBondContact O-N 2.86Å; H223-E225 VanDerWaalsContact C-N 3.33Å; H223-E225 PolarHBondContact O-N 2.82Å | ||
| 224 | C | 56.7 | Low | 63.4 | Low | 58 Ų | 58 | 105.7 Ų | 105.7 | 39% | 0.392 | 55% | 0.549 | S | S | . | . | trans | -73.2 | 87.5 | 170.1 | -63.8 | 0 | 0 | 0 | 0 | 109 | F216 | F216-C224 HydrophobicContact CD1-CB 3.91Å; F216-C224 HydrophobicContact CE1-CB 4.24Å | ||
| 225 | E | 59.1 | Low | 62.6 | Low | 151 Ų | 151 | 111.5 Ų | 111.5 | 71% | 0.706 | 57% | 0.571 | S | S | * | * | trans | -81.2 | 138.8 | 173.5 | -65 | -176.4 | -176.8 | 0 | 0 | 110.3 | H223 G227 | H223-E225 VanDerWaalsContact C-N 3.33Å; H223-E225 PolarHBondContact O-N 2.82Å; E225-G227 PolarHBondContact O-N 3.2Å; E225-G227 VanDerWaalsContact O-N 3.1Å | ||
| 226 | L | 62.8 | Low | 61.9 | Low | 49 Ų | 49 | 117 Ų | 117 | 26% | 0.257 | 61% | 0.605 | S | S | . | * | B | Isolated β-bridge | trans | -70.3 | 106.6 | 170.9 | -63.7 | 172.1 | 0 | 0 | 0 | 107 | Q215 Q228 S274 | Q215-L226 HydrophobicContact CB-CD2 4.36Å; Q215-L226 HydrophobicContact CG-CD2 4.3Å; L226-Q228 PolarHBondContact O-N 2.87Å; L226-S274 VanDerWaalsContact CD1-O 3.22Å; L226-S274 WeakPolarHBondContact CD1-O 3.48Å |
| 227 | G | 59.3 | Low | 61.8 | Low | 25 Ų | 25 | 118.3 Ų | 118.3 | 26% | 0.258 | 62% | 0.619 | S | S | . | * | trans | -54.9 | 124 | -177.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | E225 | E225-G227 PolarHBondContact O-N 3.2Å; E225-G227 VanDerWaalsContact O-N 3.1Å | ||
| 228 | Q | 59.9 | Low | 62.4 | Low | 193 Ų | 193 | 116.4 Ų | 116.4 | 90% | 0.902 | 61% | 0.611 | S | S | * | * | trans | -90.8 | -9.3 | 179.7 | -66.4 | 179.6 | -6.8 | 0 | 0 | 112.9 | L226 | L226-Q228 PolarHBondContact O-N 2.87Š| ||
| 229 | N | 52.9 | Low | 63.7 | Low | 157 Ų | 157 | 117.2 Ų | 117.2 | 84% | 0.84 | 60% | 0.597 | S | S | * | * | trans | -119.3 | 109.7 | -168.6 | -136.7 | -0.1 | 0 | 0 | 0 | 111.4 | ||||
| 230 | W | 57.9 | Low | 65.3 | Low | 149 Ų | 149 | 114.7 Ų | 114.7 | 56% | 0.564 | 58% | 0.579 | S | S | * | * | trans | -116.6 | 105.5 | 173.2 | 64 | -74.2 | 0 | 0 | 0 | 107.8 | K232 | W230-K232 HydrophobicContact CD2-CG 4.23Å; W230-K232 HydrophobicContact CE3-CB 3.94Å; W230-K232 HydrophobicContact CE3-CD 4.2Å; W230-K232 HydrophobicContact CE3-CG 3.55Å; W230-K232 HydrophobicContact CH2-CB 4.34Å; W230-K232 HydrophobicContact CH2-CD 3.18Å; W230-K232 HydrophobicContact CH2-CG 3.53Å; W230-K232 HydrophobicContact CZ2-CD 3.89Å; W230-K232 HydrophobicContact CZ2-CG 4.14Å; W230-K232 HydrophobicContact CZ3-CB 3.58Å; W230-K232 HydrophobicContact CZ3-CD 3.35Å; W230-K232 HydrophobicContact CZ3-CG 3.16Å; W230-K232 PolarHBondContact O-N 3.06Å | ||
| 231 | E | 57.4 | Low | 66.5 | Low | 184 Ų | 184 | 113.2 Ų | 113.2 | 86% | 0.86 | 57% | 0.566 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 116.5 | 162.3 | -71.8 | -179.1 | 174.9 | 0 | 0 | 107.1 | K233 | E231-K233 PolarHBondContact O-N 3.37Š|
| 232 | K | 59.6 | Low | 67.7 | Low | 137 Ų | 137 | 112 Ų | 112 | 60% | 0.596 | 55% | 0.548 | S | S | * | . | P | Polyproline II helix | trans | -64.2 | 116.4 | 176 | -38.6 | -156.8 | 175.5 | -171.1 | 0 | 105.9 | W230 N234 | W230-K232 HydrophobicContact CD2-CG 4.23Å; W230-K232 HydrophobicContact CE3-CB 3.94Å; W230-K232 HydrophobicContact CE3-CD 4.2Å; W230-K232 HydrophobicContact CE3-CG 3.55Å; W230-K232 HydrophobicContact CH2-CB 4.34Å; W230-K232 HydrophobicContact CH2-CD 3.18Å; W230-K232 HydrophobicContact CH2-CG 3.53Å; W230-K232 HydrophobicContact CZ2-CD 3.89Å; W230-K232 HydrophobicContact CZ2-CG 4.14Å; W230-K232 HydrophobicContact CZ3-CB 3.58Å; W230-K232 HydrophobicContact CZ3-CD 3.35Å; W230-K232 HydrophobicContact CZ3-CG 3.16Å; W230-K232 PolarHBondContact O-N 3.06Å; K232-N234 PolarHBondContact O-N 2.97Å |
| 233 | K | 59.8 | Low | 69 | Low | 169 Ų | 169 | 108.5 Ų | 108.5 | 74% | 0.735 | 52% | 0.524 | S | S | * | . | P | Polyproline II helix | trans | -47.9 | 136 | 168.4 | -73.7 | -170.8 | 176.5 | -173.1 | 0 | 108.7 | E231 R235 | E231-K233 PolarHBondContact O-N 3.37Å; K233-R235 PolarHBondContact O-N 3.32Å |
| 234 | N | 65.2 | Low | 70.4 | Confident | 101 Ų | 101 | 104.2 Ų | 104.2 | 54% | 0.54 | 52% | 0.518 | S | S | . | . | trans | -54.3 | 114.7 | -179.7 | -173.6 | -7.7 | 0 | 0 | 0 | 109.3 | K232 T236 C237 | K232-N234 PolarHBondContact O-N 2.97Å; N234-T236 VanDerWaalsContact CG-OG1 3.25Å; N234-T236 PolarHBondContact ND2-OG1 3.06Å; N234-T236 VanDerWaalsContact ND2-OG1 3.15Å; N234-T236 PolarHBondContact O-N 3.24Å; N234-T236 PolarHBondContact OD1-N 3.3Å; N234-T236 PolarHBondContact OD1-OG1 2.96Å; N234-C237 PolarHBondContact O-N 3.06Å | ||
| 235 | R | 69.2 | Low | 72 | Confident | 193 Ų | 193 | 106 Ų | 106 | 73% | 0.728 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.3 | -14.3 | -176.4 | -71.2 | -171.6 | 169.6 | -158 | -2.7 | 112.7 | K233 | K233-R235 PolarHBondContact O-N 3.32Š|
| 236 | T | 70.1 | Confident | 73.5 | Confident | 115 Ų | 115 | 105.4 Ų | 105.4 | 71% | 0.706 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.1 | -10.5 | -179.9 | 66.7 | 0 | 0 | 0 | 0 | 113.3 | N234 | N234-T236 VanDerWaalsContact CG-OG1 3.25Å; N234-T236 PolarHBondContact ND2-OG1 3.06Å; N234-T236 VanDerWaalsContact ND2-OG1 3.15Å; N234-T236 PolarHBondContact O-N 3.24Å; N234-T236 PolarHBondContact OD1-N 3.3Å; N234-T236 PolarHBondContact OD1-OG1 2.96Å |
| 237 | C | 79.9 | Confident | 74.8 | Confident | 76 Ų | 76 | 106.1 Ų | 106.1 | 51% | 0.514 | 54% | 0.54 | S | S | . | . | S | Bend | trans | -126.5 | 49.3 | -176.9 | -59.4 | 0 | 0 | 0 | 0 | 111.4 | N234 Y239 | N234-C237 PolarHBondContact O-N 3.06Å; C237-Y239 HydrophobicContact CB-CE2 4.39Å |
| 238 | L | 85.2 | Confident | 76.2 | Confident | 34 Ų | 34 | 106.5 Ų | 106.5 | 18% | 0.178 | 54% | 0.535 | C | S | . | . | trans | -89.4 | 121.4 | 176.9 | -60.3 | 178.6 | 0 | 0 | 0 | 109.7 | E246 G247 L249 | L238-E246 CarbonylContact O-C 3.34Å; L238-E246 WeakPolarHBondContact O-CA 3.06Å; L238-G247 PolarHBondContact O-N 3.38Å; L238-L249 HydrophobicContact CD2-CD2 3.98Å; L238-L249 HydrophobicContact CD2-CG 4.19Å | ||
| 239 | Y | 88.7 | Confident | 77.5 | Confident | 138 Ų | 138 | 99.2 Ų | 99.2 | 54% | 0.541 | 50% | 0.502 | S | S | . | . | B | Isolated β-bridge | trans | -118.7 | 140.4 | 173.9 | -65.5 | -89.3 | 0 | 0 | 0 | 110.8 | C237 E246 H248 | C237-Y239 HydrophobicContact CB-CE2 4.39Å; Y239-E246 HydrophobicContact CD1-CB 3.95Å; Y239-E246 HydrophobicContact CE1-CB 3.66Å; Y239-H248 CarbonylContact C-O 3.33Å |
| 240 | C | 88.4 | Confident | 79 | Confident | 4 Ų | 4 | 91.9 Ų | 91.9 | 3% | 0.027 | 46% | 0.463 | C | S | . | . | trans | -83.6 | 120 | -179.2 | 178.9 | 0 | 0 | 0 | 0 | 111.1 | N242 C243 G244 N245 H248 C253 | C240-N242 PolarHBondContact O-N 3.05Å; C240-N242 VanDerWaalsContact SG-CB 3.57Å; C240-N242 PolarHBondContact SG-N 3.03Å; C240-C243 PolarHBondContact SG-N 3.33Å; C240-C243 VanDerWaalsContact SG-N 3.37Å; C240-G244 VanDerWaalsContact O-CA 3.26Å; C240-G244 WeakPolarHBondContact O-CA 3.03Å; C240-G244 PolarHBondContact O-N 3.3Å; C240-N245 WeakPolarHBondContact CB-O 3.2Å; C240-N245 PolarHBondContact N-O 3.15Å; C240-H248 WeakPolarHBondContact CA-O 3.5Å; C240-H248 VanDerWaalsContact CB-CE1 3.5Å; C240-H248 WeakPolarHBondContact CB-CE1 3.43Å; C240-H248 VanDerWaalsContact CB-NE2 3.29Å; C240-H248 WeakPolarHBondContact CB-NE2 3.5Å; C240-H248 PolarHBondContact N-O 3.28Å; C240-H248 PolarHBondContact SG-NE2 2.95Å; C240-C253 VanDerWaalsContact SG-CB 3.54Å | ||
| 241 | F | 86 | Confident | 80.3 | Confident | 146 Ų | 146 | 86.5 Ų | 86.5 | 64% | 0.64 | 45% | 0.445 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.9 | -15.3 | 174.7 | 71.8 | -103.4 | 0 | 0 | 0 | 113.7 | Q265 | F241-Q265 HydrophobicContact CZ-CG 4.47Š|
| 242 | N | 84.2 | Confident | 81.6 | Confident | 20 Ų | 20 | 83 Ų | 83 | 11% | 0.107 | 43% | 0.428 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -95.3 | -46.7 | -173.9 | -173.3 | 56 | 0 | 0 | 0 | 112.8 | C240 C253 Q255 G257 L258 | C240-N242 PolarHBondContact O-N 3.05Å; C240-N242 VanDerWaalsContact SG-CB 3.57Å; C240-N242 PolarHBondContact SG-N 3.03Å; N242-C253 HydrophobicContact CB-CB 4.22Å; N242-C253 PolarHBondContact ND2-SG 2.95Å; N242-Q255 PolarHBondContact ND2-O 3.05Å; N242-Q255 VanDerWaalsContact ND2-O 3.08Å; N242-G257 WeakPolarHBondContact ND2-CA 3.26Å; N242-G257 WeakPolarHBondContact OD1-CA 3.49Å; N242-L258 PolarHBondContact OD1-N 3.41Å |
| 243 | C | 88.8 | Confident | 82.9 | Confident | 38 Ų | 38 | 77 Ų | 77 | 26% | 0.257 | 40% | 0.403 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -114.7 | -2 | -177.9 | 72.1 | 0 | 0 | 0 | 0 | 114.1 | C240 N245 H248 Q255 | C240-C243 PolarHBondContact SG-N 3.33Å; C240-C243 VanDerWaalsContact SG-N 3.37Å; C243-N245 PolarHBondContact O-N 3.24Å; C243-H248 PolarHBondContact SG-CE1 3.24Å; C243-Q255 HydrophobicContact CB-CB 4.14Å; C243-Q255 HydrophobicContact CB-CG 3.96Å |
| 244 | G | 88.3 | Confident | 84 | Confident | 52 Ų | 52 | 75.7 Ų | 75.7 | 54% | 0.536 | 41% | 0.405 | S | S | . | . | trans | 75.6 | -22.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | C240 | C240-G244 VanDerWaalsContact O-CA 3.26Å; C240-G244 WeakPolarHBondContact O-CA 3.03Å; C240-G244 PolarHBondContact O-N 3.3Å | ||
| 245 | N | 89.8 | Confident | 84.7 | Confident | 96 Ų | 96 | 75.7 Ų | 75.7 | 51% | 0.513 | 40% | 0.401 | S | S | . | . | trans | -61.6 | 148.5 | -178.1 | -61 | -16.4 | 0 | 0 | 0 | 113.1 | C240 C243 | C240-N245 WeakPolarHBondContact CB-O 3.2Å; C240-N245 PolarHBondContact N-O 3.15Å; C243-N245 PolarHBondContact O-N 3.24Å | ||
| 246 | E | 90.5 | Very high | 84.7 | Confident | 138 Ų | 138 | 70.1 Ų | 70.1 | 65% | 0.645 | 40% | 0.396 | S | S | * | . | B | Isolated β-bridge | trans | -74.8 | 171.1 | 173.3 | 64.6 | -179.5 | -162.8 | 0 | 0 | 113.1 | L238 Y239 H248 | L238-E246 CarbonylContact O-C 3.34Å; L238-E246 WeakPolarHBondContact O-CA 3.06Å; Y239-E246 HydrophobicContact CD1-CB 3.95Å; Y239-E246 HydrophobicContact CE1-CB 3.66Å; E246-H248 PolarHBondContact O-N 3.41Å; E246-H248 PolarHBondContact O-ND1 3.22Å |
| 247 | G | 89.1 | Confident | 84.3 | Confident | 63 Ų | 63 | 65.3 Ų | 65.3 | 65% | 0.649 | 37% | 0.37 | S | S | * | . | S | Bend | trans | 85.9 | -7.1 | 172 | 0 | 0 | 0 | 0 | 0 | 115.7 | L238 | L238-G247 PolarHBondContact O-N 3.38Š|
| 248 | H | 89.9 | Confident | 83.3 | Confident | 33 Ų | 33 | 68.1 Ų | 68.1 | 15% | 0.153 | 38% | 0.379 | C | S | . | . | S | Bend | trans | -149.8 | 154.7 | 178.2 | 71.8 | -75.4 | 0 | 0 | 0 | 113.6 | Y239 C240 C243 E246 Q252 C253 | Y239-H248 CarbonylContact C-O 3.33Å; C240-H248 WeakPolarHBondContact CA-O 3.5Å; C240-H248 VanDerWaalsContact CB-CE1 3.5Å; C240-H248 WeakPolarHBondContact CB-CE1 3.43Å; C240-H248 VanDerWaalsContact CB-NE2 3.29Å; C240-H248 WeakPolarHBondContact CB-NE2 3.5Å; C240-H248 PolarHBondContact N-O 3.28Å; C240-H248 PolarHBondContact SG-NE2 2.95Å; C243-H248 PolarHBondContact SG-CE1 3.24Å; E246-H248 PolarHBondContact O-N 3.41Å; E246-H248 PolarHBondContact O-ND1 3.22Å; H248-Q252 HydrophobicContact CB-CB 4.12Å; H248-C253 PolarHBondContact NE2-SG 2.95Å |
| 249 | L | 87.2 | Confident | 82 | Confident | 40 Ų | 40 | 73.5 Ų | 73.5 | 21% | 0.209 | 40% | 0.398 | C | S | . | . | trans | -86.2 | 156 | 171.3 | -67.6 | 167.2 | 0 | 0 | 0 | 109.8 | L238 H251 Q252 P268 | L238-L249 HydrophobicContact CD2-CD2 3.98Å; L238-L249 HydrophobicContact CD2-CG 4.19Å; L249-H251 WeakPolarHBondContact CB-ND1 3.24Å; L249-H251 PolarHBondContact O-N 3.21Å; L249-Q252 WeakPolarHBondContact O-CA 3.44Å; L249-Q252 WeakPolarHBondContact O-CB 3.4Å; L249-Q252 PolarHBondContact O-N 3.35Å; L249-P268 HydrophobicContact CD1-CG 3.85Å | ||
| 250 | G | 84.8 | Confident | 80.5 | Confident | 3 Ų | 3 | 71.1 Ų | 71.1 | 3% | 0.031 | 40% | 0.395 | C | S | . | . | G | 310 helix | trans | -60.3 | -22.5 | -174.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | Q252 C253 Q265 | G250-Q252 PolarHBondContact O-N 3.43Å; G250-C253 WeakPolarHBondContact O-CB 2.79Å; G250-C253 PolarHBondContact O-N 3.39Å; G250-Q265 PolarHBondContact O-NE2 3.26Å; G250-Q265 PolarHBondContact O-OE1 3Å |
| 251 | H | 83.4 | Confident | 79 | Confident | 37 Ų | 37 | 75.7 Ų | 75.7 | 17% | 0.171 | 42% | 0.419 | C | S | . | . | G | 310 helix | trans | -71.2 | -12.4 | 171.8 | 78.6 | -78.3 | 0 | 0 | 0 | 115.4 | L249 Q265 F266 P268 Y269 | L249-H251 WeakPolarHBondContact CB-ND1 3.24Å; L249-H251 PolarHBondContact O-N 3.21Å; H251-Q265 HydrophobicContact CB-CB 4.05Å; H251-F266 WeakPolarHBondContact CB-O 3.04Å; H251-P268 WeakPolarHBondContact ND1-CD 3.13Å; H251-Y269 AromaticContact CE1-CE1 3.89Å; H251-Y269 PolarHBondContact NE2-OH 3.36Å |
| 252 | Q | 86.4 | Confident | 77.9 | Confident | 109 Ų | 109 | 75.1 Ų | 75.1 | 51% | 0.509 | 41% | 0.412 | S | S | . | . | G | 310 helix | trans | -102.6 | 1.1 | 175.6 | -58.8 | 166.9 | -68.2 | 0 | 0 | 110.8 | H248 L249 G250 N254 | H248-Q252 HydrophobicContact CB-CB 4.12Å; L249-Q252 WeakPolarHBondContact O-CA 3.44Å; L249-Q252 WeakPolarHBondContact O-CB 3.4Å; L249-Q252 PolarHBondContact O-N 3.35Å; G250-Q252 PolarHBondContact O-N 3.43Å; Q252-N254 PolarHBondContact O-N 3.47Å |
| 253 | C | 86.4 | Confident | 77 | Confident | 12 Ų | 12 | 78.9 Ų | 78.9 | 8% | 0.081 | 43% | 0.432 | C | S | . | . | trans | -74.6 | 123.6 | -174.8 | -169.3 | 0 | 0 | 0 | 0 | 110.5 | C240 N242 H248 G250 | C240-C253 VanDerWaalsContact SG-CB 3.54Å; N242-C253 HydrophobicContact CB-CB 4.22Å; N242-C253 PolarHBondContact ND2-SG 2.95Å; H248-C253 PolarHBondContact NE2-SG 2.95Å; G250-C253 WeakPolarHBondContact O-CB 2.79Å; G250-C253 PolarHBondContact O-N 3.39Å | ||
| 254 | N | 82.2 | Confident | 76.2 | Confident | 142 Ų | 142 | 78 Ų | 78 | 76% | 0.759 | 42% | 0.424 | S | S | * | . | trans | -90.5 | -0.7 | 176 | 65.1 | 0.3 | 0 | 0 | 0 | 113.5 | Q252 | Q252-N254 PolarHBondContact O-N 3.47Š| ||
| 255 | Q | 79.9 | Confident | 75.6 | Confident | 101 Ų | 101 | 78.3 Ų | 78.3 | 47% | 0.472 | 41% | 0.411 | S | S | . | . | S | Bend | trans | -82.2 | 138.1 | 177.3 | -59.6 | -59.5 | -42.4 | 0 | 0 | 110.6 | N242 C243 G257 | N242-Q255 PolarHBondContact ND2-O 3.05Å; N242-Q255 VanDerWaalsContact ND2-O 3.08Å; C243-Q255 HydrophobicContact CB-CB 4.14Å; C243-Q255 HydrophobicContact CB-CG 3.96Å; Q255-G257 PolarHBondContact O-N 3.2Å |
| 256 | A | 69.3 | Low | 75.2 | Confident | 75 Ų | 75 | 76.4 Ų | 76.4 | 62% | 0.62 | 40% | 0.398 | S | S | * | . | trans | -57.9 | 112.6 | 171.3 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 257 | G | 62.2 | Low | 75 | Confident | 15 Ų | 15 | 71.5 Ų | 71.5 | 16% | 0.155 | 37% | 0.374 | C | S | . | . | trans | -71.5 | 171.8 | -167.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | N242 Q255 Y259 N260 | N242-G257 WeakPolarHBondContact ND2-CA 3.26Å; N242-G257 WeakPolarHBondContact OD1-CA 3.49Å; Q255-G257 PolarHBondContact O-N 3.2Å; G257-Y259 PolarHBondContact O-N 3.32Å; G257-N260 PolarHBondContact O-N 3.35Å | ||
| 258 | L | 58.9 | Low | 74.8 | Confident | 134 Ų | 134 | 72.3 Ų | 72.3 | 70% | 0.702 | 37% | 0.368 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -47.3 | -21.7 | 174.2 | -75.7 | 162.7 | 0 | 0 | 0 | 113.6 | N242 | N242-L258 PolarHBondContact OD1-N 3.41Š|
| 259 | Y | 57.5 | Low | 74.4 | Confident | 147 Ų | 147 | 75.9 Ų | 75.9 | 58% | 0.576 | 38% | 0.381 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115 | 24.2 | -179.2 | -56.7 | -78 | 0 | 0 | 0 | 114.1 | G257 N261 R262 I263 | G257-Y259 PolarHBondContact O-N 3.32Å; Y259-N261 VanDerWaalsContact C-N 3.35Å; Y259-N261 PolarHBondContact O-N 3.4Å; Y259-R262 WeakPolarHBondContact O-CA 3.4Å; Y259-R262 WeakPolarHBondContact O-CB 3.23Å; Y259-R262 WeakPolarHBondContact O-CG 3.41Å; Y259-R262 PolarHBondContact O-N 3.11Å; Y259-I263 HydrophobicContact CD2-CD1 4.11Å; Y259-I263 HydrophobicContact CG-CD1 4.08Å |
| 260 | N | 56.5 | Low | 74.5 | Confident | 89 Ų | 89 | 74.8 Ų | 74.8 | 48% | 0.476 | 38% | 0.376 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 50.2 | 50.9 | 174 | -161.2 | 11.3 | 0 | 0 | 0 | 112.8 | G257 R262 | G257-N260 PolarHBondContact O-N 3.35Å; N260-R262 PolarHBondContact O-N 3.38Å |
| 261 | N | 58.5 | Low | 74.7 | Confident | 99 Ų | 99 | 77 Ų | 77 | 53% | 0.529 | 39% | 0.389 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.2 | 26.4 | -176.2 | -60.1 | -18.4 | 0 | 0 | 0 | 114.2 | R188 Y192 Y259 | R188-N261 PolarHBondContact NH2-O 3.08Å; R188-N261 VanDerWaalsContact NH2-O 3.1Å; Y192-N261 VanDerWaalsContact CE1-O 3.25Å; Y192-N261 WeakPolarHBondContact CE1-O 3.42Å; Y192-N261 PolarHBondContact OH-O 2.81Å; Y192-N261 VanDerWaalsContact OH-O 3.1Å; Y259-N261 VanDerWaalsContact C-N 3.35Å; Y259-N261 PolarHBondContact O-N 3.4Å |
| 262 | R | 62.3 | Low | 74.8 | Confident | 134 Ų | 134 | 78.3 Ų | 78.3 | 51% | 0.506 | 40% | 0.399 | S | S | . | . | trans | -81 | -16.9 | -178.7 | -69.4 | -172 | -106.3 | -160.9 | -2.3 | 115.2 | R188 Y192 Y259 N260 | R188-R262 PolarHBondContact NH1-O 3.34Å; Y192-R262 PolarHBondContact OH-O 2.82Å; Y259-R262 WeakPolarHBondContact O-CA 3.4Å; Y259-R262 WeakPolarHBondContact O-CB 3.23Å; Y259-R262 WeakPolarHBondContact O-CG 3.41Å; Y259-R262 PolarHBondContact O-N 3.11Å; N260-R262 PolarHBondContact O-N 3.38Å | ||
| 263 | I | 64.6 | Low | 74.8 | Confident | 100 Ų | 100 | 77.6 Ų | 77.6 | 51% | 0.513 | 39% | 0.393 | S | S | . | . | S | Bend | trans | -123.3 | 127.2 | -178.4 | -56 | 176.8 | 0 | 0 | 0 | 107.6 | Y259 | Y259-I263 HydrophobicContact CD2-CD1 4.11Å; Y259-I263 HydrophobicContact CG-CD1 4.08Å |
| 264 | F | 72.2 | Confident | 74.8 | Confident | 20 Ų | 20 | 77.4 Ų | 77.4 | 9% | 0.088 | 39% | 0.392 | C | S | . | . | trans | -67.9 | 132.8 | 174.4 | -60.7 | -73.9 | 0 | 0 | 0 | 110 | F175 I191 Y192 R202 G203 F266 | F175-F264 HydrophobicContact CE2-CD2 4.21Å; F175-F264 HydrophobicContact CZ-CD2 4.32Å; I191-F264 HydrophobicContact CG2-CE2 3.84Å; I191-F264 HydrophobicContact CG2-CZ 3.92Å; Y192-F264 HydrophobicContact CD1-CD1 4.47Å; Y192-F264 AromaticContact CD1-CE1 3.45Å; Y192-F264 HydrophobicContact CD1-CE1 3.45Å; Y192-F264 VanDerWaalsContact CD1-CE1 3.45Å; Y192-F264 AromaticContact CD1-CZ 3.75Å; Y192-F264 HydrophobicContact CD1-CZ 3.75Å; Y192-F264 AromaticContact CD2-CE1 3.72Å; Y192-F264 HydrophobicContact CD2-CE1 3.72Å; Y192-F264 AromaticContact CD2-CE2 3.94Å; Y192-F264 HydrophobicContact CD2-CE2 3.94Å; Y192-F264 AromaticContact CD2-CZ 3.07Å; Y192-F264 HydrophobicContact CD2-CZ 3.07Å; Y192-F264 HydrophobicContact CE1-CD1 4.21Å; Y192-F264 AromaticContact CE1-CE1 3.49Å; Y192-F264 HydrophobicContact CE1-CE1 3.49Å; Y192-F264 VanDerWaalsContact CE1-CE1 3.49Å; Y192-F264 AromaticContact CE1-CZ 3.73Å; Y192-F264 HydrophobicContact CE1-CZ 3.73Å; Y192-F264 AromaticContact CE2-CE1 3.75Å; Y192-F264 HydrophobicContact CE2-CE1 3.75Å; Y192-F264 AromaticContact CE2-CE2 3.49Å; Y192-F264 HydrophobicContact CE2-CE2 3.49Å; Y192-F264 VanDerWaalsContact CE2-CE2 3.49Å; Y192-F264 AromaticContact CE2-CZ 3.03Å; Y192-F264 HydrophobicContact CE2-CZ 3.03Å; Y192-F264 AromaticContact CG-CE1 3.53Å; Y192-F264 HydrophobicContact CG-CE1 3.53Å; Y192-F264 AromaticContact CG-CZ 3.41Å; Y192-F264 HydrophobicContact CG-CZ 3.41Å; Y192-F264 VanDerWaalsContact CG-CZ 3.41Å; Y192-F264 AromaticContact CZ-CE1 3.57Å; Y192-F264 AromaticContact CZ-CE2 3.78Å; Y192-F264 AromaticContact CZ-CZ 3.32Å; R202-F264 HydrophobicContact CB-CD1 4.46Å; G203-F264 VanDerWaalsContact CA-CD2 3.44Å; G203-F264 WeakPolarHBondContact O-CD2 3.21Å; G203-F264 WeakPolarHBondContact O-CE2 3.33Å; F264-F266 HydrophobicContact CB-CE2 4.38Å; F264-F266 HydrophobicContact CB-CZ 4.19Å; F264-F266 WeakPolarHBondContact O-CD2 3.39Å; F264-F266 PolarHBondContact O-N 3.48Å | ||
| 265 | Q | 76 | Confident | 75 | Confident | 57 Ų | 57 | 73.8 Ų | 73.8 | 27% | 0.266 | 38% | 0.375 | S | S | . | . | trans | -85.5 | 103.8 | 178.5 | -54 | 166.3 | -17.4 | 0 | 0 | 108.4 | F241 G250 H251 | F241-Q265 HydrophobicContact CZ-CG 4.47Å; G250-Q265 PolarHBondContact O-NE2 3.26Å; G250-Q265 PolarHBondContact O-OE1 3Å; H251-Q265 HydrophobicContact CB-CB 4.05Å | ||
| 266 | F | 80.8 | Confident | 75.2 | Confident | 57 Ų | 57 | 72.9 Ų | 72.9 | 25% | 0.25 | 37% | 0.373 | C | S | . | . | trans | -78.4 | 149.8 | 175.8 | -58.5 | -77.4 | 0 | 0 | 0 | 110.8 | F175 H204 P210 H251 F264 | F175-F266 HydrophobicContact CE2-CZ 4.39Å; H204-F266 HydrophobicContact CB-CE1 4.39Å; H204-F266 AromaticContact ND1-CE1 3.56Å; P210-F266 HydrophobicContact CG-CB 4.44Å; P210-F266 HydrophobicContact CG-CD1 3.44Å; P210-F266 VanDerWaalsContact CG-CD1 3.44Å; P210-F266 HydrophobicContact CG-CE1 3.75Å; P210-F266 HydrophobicContact CG-CG 3.98Å; H251-F266 WeakPolarHBondContact CB-O 3.04Å; F264-F266 HydrophobicContact CB-CE2 4.38Å; F264-F266 HydrophobicContact CB-CZ 4.19Å; F264-F266 WeakPolarHBondContact O-CD2 3.39Å; F264-F266 PolarHBondContact O-N 3.48Å | ||
| 267 | K | 87 | Confident | 76 | Confident | 34 Ų | 34 | 74 Ų | 74 | 15% | 0.148 | 37% | 0.365 | C | S | . | . | trans | -59.3 | 136.2 | 167.6 | -73.3 | 166.5 | 174.7 | 175 | 0 | 109.7 | C199 R214 Y269 T271 | C199-K267 PolarHBondContact O-NZ 3.29Å; R214-K267 VanDerWaalsContact CZ-O 3.24Å; R214-K267 PolarHBondContact NH1-O 2.84Å; R214-K267 PolarHBondContact NH2-O 3.05Å; K267-Y269 HydrophobicContact CB-CD2 4.42Å; K267-Y269 HydrophobicContact CB-CE1 4.29Å; K267-Y269 HydrophobicContact CB-CE2 4.2Å; K267-Y269 HydrophobicContact CD-CE2 3.88Å; K267-Y269 HydrophobicContact CG-CE1 4.45Å; K267-Y269 HydrophobicContact CG-CE2 4.2Å; K267-Y269 PolarHBondContact O-N 3.19Å; K267-T271 WeakPolarHBondContact CD-OG1 3.42Å; K267-T271 PolarHBondContact NZ-OG1 3.01Å | ||
| 268 | P | 84.3 | Confident | 77.3 | Confident | 80 Ų | 80 | 77.4 Ų | 77.4 | 52% | 0.519 | 38% | 0.377 | S | S | . | . | S | Bend | trans | -82.4 | 18 | 177.7 | 33.9 | -34.4 | 0 | 0 | 0 | 112.9 | L249 H251 | L249-P268 HydrophobicContact CD1-CG 3.85Å; H251-P268 WeakPolarHBondContact ND1-CD 3.13Å |
| 269 | Y | 82.8 | Confident | 78.5 | Confident | 109 Ų | 109 | 72.1 Ų | 72.1 | 43% | 0.427 | 35% | 0.35 | S | S | . | . | S | Bend | trans | -146.5 | 162.9 | -178 | 53.4 | -96.8 | 0 | 0 | 0 | 109.4 | H251 K267 | H251-Y269 AromaticContact CE1-CE1 3.89Å; H251-Y269 PolarHBondContact NE2-OH 3.36Å; K267-Y269 HydrophobicContact CB-CD2 4.42Å; K267-Y269 HydrophobicContact CB-CE1 4.29Å; K267-Y269 HydrophobicContact CB-CE2 4.2Å; K267-Y269 HydrophobicContact CD-CE2 3.88Å; K267-Y269 HydrophobicContact CG-CE1 4.45Å; K267-Y269 HydrophobicContact CG-CE2 4.2Å; K267-Y269 PolarHBondContact O-N 3.19Å |
| 270 | V | 87.8 | Confident | 79.8 | Confident | 17 Ų | 17 | 72.2 Ų | 72.2 | 10% | 0.103 | 35% | 0.349 | C | S | . | . | trans | -79.3 | 127.4 | 176.4 | -179.4 | 0 | 0 | 0 | 0 | 109 | R214 Q215 V272 Y273 | R214-V270 HydrophobicContact CB-CG2 3.61Å; R214-V270 WeakPolarHBondContact O-CG2 3.05Å; Q215-V270 HydrophobicContact CB-CG1 4.04Å; Q215-V270 HydrophobicContact CB-CG2 4.23Å; V270-V272 WeakPolarHBondContact CG1-O 3.15Å; V270-Y273 HydrophobicContact CB-CD2 4.46Å; V270-Y273 HydrophobicContact CB-CE1 4.39Å; V270-Y273 HydrophobicContact CB-CE2 3.89Å; V270-Y273 HydrophobicContact CG1-CD1 4.3Å; V270-Y273 HydrophobicContact CG1-CD2 3.92Å; V270-Y273 HydrophobicContact CG1-CE1 4.22Å; V270-Y273 HydrophobicContact CG1-CE2 3.86Å; V270-Y273 HydrophobicContact CG1-CG 4.14Å; V270-Y273 HydrophobicContact CG2-CE1 4.36Å | ||
| 271 | T | 88.7 | Confident | 81.2 | Confident | 50 Ų | 50 | 72.3 Ų | 72.3 | 31% | 0.307 | 35% | 0.349 | S | S | . | . | S | Bend | trans | -80.4 | -41.3 | 175.3 | -45.4 | 0 | 0 | 0 | 0 | 111.1 | D211 K267 | D211-T271 WeakPolarHBondContact OD2-CA 3.17Å; D211-T271 WeakPolarHBondContact OD2-CB 3.3Å; D211-T271 PolarHBondContact OD2-N 2.83Å; D211-T271 PolarHBondContact OD2-OG1 3.15Å; K267-T271 WeakPolarHBondContact CD-OG1 3.42Å; K267-T271 PolarHBondContact NZ-OG1 3.01Å |
| 272 | V | 86.3 | Confident | 82.3 | Confident | 63 Ų | 63 | 70.5 Ų | 70.5 | 38% | 0.382 | 34% | 0.341 | S | S | . | . | trans | -135.9 | 124.9 | -176.8 | -179 | 0 | 0 | 0 | 0 | 109.5 | R198 V270 | R198-V272 PolarHBondContact NH2-O 2.96Å; R198-V272 VanDerWaalsContact NH2-O 3.15Å; V270-V272 WeakPolarHBondContact CG1-O 3.15Å | ||
| 273 | Y | 86.1 | Confident | 83.2 | Confident | 94 Ų | 94 | 70.1 Ų | 70.1 | 37% | 0.369 | 34% | 0.343 | S | S | . | . | P | Polyproline II helix | trans | -88.3 | 119.2 | 168.1 | -73.2 | -92.8 | 0 | 0 | 0 | 108.6 | Q215 H217 V270 | Q215-Y273 HydrophobicContact CB-CD1 3.7Å; Q215-Y273 HydrophobicContact CB-CE1 3.92Å; H217-Y273 AromaticContact CD2-CE1 3.99Å; H217-Y273 AromaticContact NE2-CE1 3.52Å; H217-Y273 AromaticContact NE2-CZ 3.6Å; H217-Y273 PolarHBondContact NE2-OH 3.37Å; V270-Y273 HydrophobicContact CB-CD2 4.46Å; V270-Y273 HydrophobicContact CB-CE1 4.39Å; V270-Y273 HydrophobicContact CB-CE2 3.89Å; V270-Y273 HydrophobicContact CG1-CD1 4.3Å; V270-Y273 HydrophobicContact CG1-CD2 3.92Å; V270-Y273 HydrophobicContact CG1-CE1 4.22Å; V270-Y273 HydrophobicContact CG1-CE2 3.86Å; V270-Y273 HydrophobicContact CG1-CG 4.14Å; V270-Y273 HydrophobicContact CG2-CE1 4.36Å |
| 274 | S | 86.1 | Confident | 83.9 | Confident | 9 Ų | 9 | 68.8 Ų | 68.8 | 6% | 0.063 | 34% | 0.34 | C | S | . | . | P | Polyproline II helix | trans | -92.2 | 147.6 | 170.4 | -77.8 | 0 | 0 | 0 | 0 | 111.4 | R198 Q215 L226 E278 | R198-S274 PolarHBondContact NH1-OG 3.28Å; R198-S274 PolarHBondContact NH2-OG 3.49Å; Q215-S274 PolarHBondContact NE2-O 2.81Å; L226-S274 VanDerWaalsContact CD1-O 3.22Å; L226-S274 WeakPolarHBondContact CD1-O 3.48Å; S274-E278 WeakPolarHBondContact CA-OE2 3.16Å; S274-E278 WeakPolarHBondContact CB-OE2 3.42Å; S274-E278 PolarHBondContact OG-OE2 3.47Å; S274-E278 VanDerWaalsContact OG-OE2 3.14Å |
| 275 | T | 87.1 | Confident | 84 | Confident | 66 Ų | 66 | 71.6 Ų | 71.6 | 41% | 0.405 | 36% | 0.361 | S | S | . | . | P | Polyproline II helix | trans | -63.6 | 158 | 168.1 | 68.9 | 0 | 0 | 0 | 0 | 110.5 | E277 E278 L279 | T275-E277 PolarHBondContact O-N 3.24Å; T275-E278 PolarHBondContact N-OE2 3.01Å; T275-E278 PolarHBondContact O-N 3.22Å; T275-E278 VanDerWaalsContact OG1-CG 3.29Å; T275-E278 WeakPolarHBondContact OG1-CG 3.25Å; T275-E278 PolarHBondContact OG1-N 3.38Å; T275-E278 VanDerWaalsContact OG1-N 3.13Å; T275-L279 WeakPolarHBondContact O-CG 3.17Å; T275-L279 PolarHBondContact O-N 3.32Å; T275-L279 VanDerWaalsContact O-N 3.11Å |
| 276 | L | 83.8 | Confident | 83.9 | Confident | 81 Ų | 81 | 73 Ų | 73 | 42% | 0.424 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -58.1 | -31 | 173.7 | -71.2 | 175.5 | 0 | 0 | 0 | 111.8 | F216 R280 | F216-L276 HydrophobicContact CE1-CD2 4.07Å; L276-R280 VanDerWaalsContact O-CG 3.28Å; L276-R280 WeakPolarHBondContact O-CG 3.48Å; L276-R280 PolarHBondContact O-N 3.08Å |
| 277 | E | 87.4 | Confident | 83.7 | Confident | 99 Ų | 99 | 76.6 Ų | 76.6 | 46% | 0.463 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -71 | -46.1 | 178.7 | -167.9 | 56.1 | -154.4 | 0 | 0 | 112.1 | T275 L279 R280 I281 | T275-E277 PolarHBondContact O-N 3.24Å; E277-L279 VanDerWaalsContact C-N 3.26Å; E277-L279 PolarHBondContact O-N 3Å; E277-R280 WeakPolarHBondContact O-CB 3.44Å; E277-R280 PolarHBondContact O-N 3.39Å; E277-R280 VanDerWaalsContact O-N 3.11Å; E277-R280 IonicContact OE2-NH1 3.71Å; E277-R280 PolarHBondContact OE2-NH1 3.21Å; E277-I281 HydrophobicContact CG-CD1 4.25Å; E277-I281 WeakPolarHBondContact O-CG1 3.19Å; E277-I281 PolarHBondContact O-N 2.81Å |
| 278 | E | 87.8 | Confident | 82.8 | Confident | 86 Ų | 86 | 82 Ų | 82 | 40% | 0.402 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -57.9 | -39.2 | 173.8 | -73.7 | 162.1 | -165.9 | 0 | 0 | 112.4 | S274 T275 T282 | S274-E278 WeakPolarHBondContact CA-OE2 3.16Å; S274-E278 WeakPolarHBondContact CB-OE2 3.42Å; S274-E278 PolarHBondContact OG-OE2 3.47Å; S274-E278 VanDerWaalsContact OG-OE2 3.14Å; T275-E278 PolarHBondContact N-OE2 3.01Å; T275-E278 PolarHBondContact O-N 3.22Å; T275-E278 VanDerWaalsContact OG1-CG 3.29Å; T275-E278 WeakPolarHBondContact OG1-CG 3.25Å; T275-E278 PolarHBondContact OG1-N 3.38Å; T275-E278 VanDerWaalsContact OG1-N 3.13Å; E278-T282 WeakPolarHBondContact O-CB 3.4Å; E278-T282 PolarHBondContact O-N 3.26Å; E278-T282 PolarHBondContact O-OG1 2.85Å |
| 279 | L | 85.2 | Confident | 81.2 | Confident | 24 Ų | 24 | 84 Ų | 84 | 13% | 0.126 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -66.6 | -40.1 | 175.7 | -70 | -177.6 | 0 | 0 | 0 | 112.4 | V212 F216 T275 E277 T282 K283 | V212-L279 HydrophobicContact CG1-CD2 4.13Å; F216-L279 HydrophobicContact CE1-CD1 4.36Å; F216-L279 HydrophobicContact CE2-CD1 3.94Å; F216-L279 HydrophobicContact CZ-CD1 3.44Å; F216-L279 VanDerWaalsContact CZ-CD1 3.44Å; T275-L279 WeakPolarHBondContact O-CG 3.17Å; T275-L279 PolarHBondContact O-N 3.32Å; T275-L279 VanDerWaalsContact O-N 3.11Å; E277-L279 VanDerWaalsContact C-N 3.26Å; E277-L279 PolarHBondContact O-N 3Å; L279-T282 PolarHBondContact O-N 3.16Å; L279-K283 WeakPolarHBondContact O-CB 3.5Å; L279-K283 PolarHBondContact O-N 3.03Å |
| 280 | R | 85.8 | Confident | 81.1 | Confident | 148 Ų | 148 | 82.8 Ų | 82.8 | 56% | 0.558 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -63.3 | -44.6 | 175.7 | -74.4 | 169.8 | -171.5 | 158 | -1.9 | 111.5 | L276 E277 T282 K283 T284 | L276-R280 VanDerWaalsContact O-CG 3.28Å; L276-R280 WeakPolarHBondContact O-CG 3.48Å; L276-R280 PolarHBondContact O-N 3.08Å; E277-R280 WeakPolarHBondContact O-CB 3.44Å; E277-R280 PolarHBondContact O-N 3.39Å; E277-R280 VanDerWaalsContact O-N 3.11Å; E277-R280 IonicContact OE2-NH1 3.71Å; E277-R280 PolarHBondContact OE2-NH1 3.21Å; R280-T282 VanDerWaalsContact C-N 3.35Å; R280-K283 PolarHBondContact O-N 3.37Å; R280-T284 WeakPolarHBondContact O-CB 3.4Å; R280-T284 PolarHBondContact O-N 3.47Å; R280-T284 PolarHBondContact O-OG1 2.95Å |
| 281 | I | 85.1 | Confident | 80.8 | Confident | 92 Ų | 92 | 86.2 Ų | 86.2 | 47% | 0.472 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -60.4 | -47.6 | 176.3 | -66 | 165.7 | 0 | 0 | 0 | 109.8 | E277 K283 T284 S285 | E277-I281 HydrophobicContact CG-CD1 4.25Å; E277-I281 WeakPolarHBondContact O-CG1 3.19Å; E277-I281 PolarHBondContact O-N 2.81Å; I281-K283 PolarHBondContact O-N 3.15Å; I281-T284 PolarHBondContact O-N 2.97Å; I281-S285 PolarHBondContact O-N 3.23Å; I281-S285 PolarHBondContact O-OG 3.4Å; I281-S285 VanDerWaalsContact O-OG 3.14Å |
| 282 | T | 81.5 | Confident | 80.3 | Confident | 60 Ų | 60 | 88.2 Ų | 88.2 | 37% | 0.368 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -61.2 | -43.7 | 179.9 | -56.1 | 0 | 0 | 0 | 0 | 111.8 | E278 L279 R280 S285 Q286 | E278-T282 WeakPolarHBondContact O-CB 3.4Å; E278-T282 PolarHBondContact O-N 3.26Å; E278-T282 PolarHBondContact O-OG1 2.85Å; L279-T282 PolarHBondContact O-N 3.16Å; R280-T282 VanDerWaalsContact C-N 3.35Å; T282-S285 PolarHBondContact O-N 3.44Å; T282-Q286 VanDerWaalsContact O-CG 3.3Å; T282-Q286 WeakPolarHBondContact O-CG 3.29Å; T282-Q286 PolarHBondContact O-N 3.02Å; T282-Q286 VanDerWaalsContact O-N 3.11Å |
| 283 | K | 81.1 | Confident | 80 | Confident | 127 Ų | 127 | 89.7 Ų | 89.7 | 55% | 0.552 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -62.8 | -45.7 | 177.6 | -175.9 | 177.5 | 172.2 | -177.6 | 0 | 111.5 | L279 R280 I281 S285 Q286 E287 | L279-K283 WeakPolarHBondContact O-CB 3.5Å; L279-K283 PolarHBondContact O-N 3.03Å; R280-K283 PolarHBondContact O-N 3.37Å; I281-K283 PolarHBondContact O-N 3.15Å; K283-S285 VanDerWaalsContact C-N 3.34Å; K283-S285 PolarHBondContact O-N 3.48Å; K283-Q286 PolarHBondContact O-N 3.43Å; K283-Q286 VanDerWaalsContact O-N 3.13Å; K283-E287 WeakPolarHBondContact CE-OE1 3.45Å; K283-E287 IonicContact NZ-OE1 3.68Å; K283-E287 WeakPolarHBondContact O-CG 3.21Å; K283-E287 PolarHBondContact O-N 3.41Å; K283-E287 VanDerWaalsContact O-N 3.08Å |
| 284 | T | 78.4 | Confident | 79.6 | Confident | 72 Ų | 72 | 89.4 Ų | 89.4 | 44% | 0.442 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.2 | -42.8 | 178.4 | -50.7 | 0 | 0 | 0 | 0 | 111.3 | R280 I281 Q286 E287 L288 | R280-T284 WeakPolarHBondContact O-CB 3.4Å; R280-T284 PolarHBondContact O-N 3.47Å; R280-T284 PolarHBondContact O-OG1 2.95Å; I281-T284 PolarHBondContact O-N 2.97Å; T284-Q286 VanDerWaalsContact C-N 3.28Å; T284-Q286 PolarHBondContact O-N 2.92Å; T284-E287 PolarHBondContact O-N 2.9Å; T284-L288 HydrophobicContact CG2-CD1 4.05Å; T284-L288 WeakPolarHBondContact O-CG 3.33Å; T284-L288 PolarHBondContact O-N 3.01Å |
| 285 | S | 75.6 | Confident | 79.1 | Confident | 78 Ų | 78 | 94.8 Ų | 94.8 | 55% | 0.545 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.1 | -29.4 | 176.4 | -62.4 | 0 | 0 | 0 | 0 | 113.5 | I281 T282 K283 | I281-S285 PolarHBondContact O-N 3.23Å; I281-S285 PolarHBondContact O-OG 3.4Å; I281-S285 VanDerWaalsContact O-OG 3.14Å; T282-S285 PolarHBondContact O-N 3.44Å; K283-S285 VanDerWaalsContact C-N 3.34Å; K283-S285 PolarHBondContact O-N 3.48Å |
| 286 | Q | 74.2 | Confident | 78.6 | Confident | 86 Ų | 86 | 96.9 Ų | 96.9 | 40% | 0.402 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -79.3 | -25.7 | 176.9 | -72.9 | 173.4 | 1.6 | 0 | 0 | 113.3 | K207 T282 K283 T284 | K207-Q286 HydrophobicContact CB-CG 4.49Å; T282-Q286 VanDerWaalsContact O-CG 3.3Å; T282-Q286 WeakPolarHBondContact O-CG 3.29Å; T282-Q286 PolarHBondContact O-N 3.02Å; T282-Q286 VanDerWaalsContact O-N 3.11Å; K283-Q286 PolarHBondContact O-N 3.43Å; K283-Q286 VanDerWaalsContact O-N 3.13Å; T284-Q286 VanDerWaalsContact C-N 3.28Å; T284-Q286 PolarHBondContact O-N 2.92Å |
| 287 | E | 76 | Confident | 78.2 | Confident | 133 Ų | 133 | 98.1 Ų | 98.1 | 62% | 0.621 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -79.8 | -25.2 | 175.8 | -71 | 170.5 | 175.4 | 0 | 0 | 111.9 | K283 T284 | K283-E287 WeakPolarHBondContact CE-OE1 3.45Å; K283-E287 IonicContact NZ-OE1 3.68Å; K283-E287 WeakPolarHBondContact O-CG 3.21Å; K283-E287 PolarHBondContact O-N 3.41Å; K283-E287 VanDerWaalsContact O-N 3.08Å; T284-E287 PolarHBondContact O-N 2.9Å |
| 288 | L | 68.2 | Low | 77.4 | Confident | 148 Ų | 148 | 98 Ų | 98 | 78% | 0.775 | 54% | 0.543 | S | S | * | . | trans | -90.2 | -10.1 | -178.8 | -69.9 | 170.6 | 0 | 0 | 0 | 115 | T284 | T284-L288 HydrophobicContact CG2-CD1 4.05Å; T284-L288 WeakPolarHBondContact O-CG 3.33Å; T284-L288 PolarHBondContact O-N 3.01Å | ||
| 289 | G | 50.1 | Low | 76.5 | Confident | 122 Ų | 122 | 99.1 Ų | 99.1 | 100% | 1.258 | 56% | 0.556 | S | S | * | * | trans | -116.8 | 0 | -173.4 | 0 | 0 | 0 | 0 | 0 | 114.2 |
Retrieved 289 of 289 residues in 415.3 ms
(Link to these results)